T2M

TERT-BUTYL 2-CYANO-2-METHYLHYDRAZINECARBOXYLATE

Created:	2005-02-07
Last modified:	2024-09-27

Find Related PDB Entry
1 entries where T2M is covalently linked to polymer or other heterogen groups

Help Find related ligands:
Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Help

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	0
Bond Count	24
Aromatic Bond Count	0

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	TERT-BUTYL 2-CYANO-2-METHYLHYDRAZINECARBOXYLATE
Systematic Name (OpenEye OEToolkits)	tert-butyl N-(cyano-methyl-amino)carbamate
Formula	C₇ H₁₃ N₃ O₂
Molecular Weight	171.197
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(OC(C)(C)C)NN(C#N)C
SMILES	CACTVS	3.341	CN(NC(=O)OC(C)(C)C)C#N
SMILES	OpenEye OEToolkits	1.5.0	CC(C)(C)OC(=O)NN(C)C#N
Canonical SMILES	CACTVS	3.341	CN(NC(=O)OC(C)(C)C)C#N
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC(C)(C)OC(=O)NN(C)C#N
InChI	InChI	1.03	InChI=1S/C7H13N3O2/c1-7(2,3)12-6(11)9-10(4)5-8/h1-4H3,(H,9,11)
InChIKey	InChI	1.03	SWELYBAPJHIOQT-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License

DrugBank ID	DB08594
Name	TERT-BUTYL 2-CYANO-2-METHYLHYDRAZINECARBOXYLATE
Groups	experimental
Synonyms	TERT-BUTYL 2-CYANO-2-METHYLHYDRAZINECARBOXYLATE

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License

Name	Target Sequence	Pharmacological Action	Actions
Cathepsin K	MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIW...	unknown	inhibitor

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682