74U

N-[(furan-2-yl)methyl]-2-phenylquinazolin-4-amine

Created:	2016-08-24
Last modified:	2016-11-02

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1 entries where 74U is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	38
Chiral Atom Count	0
Bond Count	41
Aromatic Bond Count	22

2D diagram of 74U

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Chemical Component Summary
Name	N-[(furan-2-yl)methyl]-2-phenylquinazolin-4-amine
Systematic Name (OpenEye OEToolkits)	~{N}-(furan-2-ylmethyl)-2-phenyl-quinazolin-4-amine
Formula	C₁₉ H₁₅ N₃ O
Molecular Weight	301.342
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c2(nc(NCc1ccco1)c3c(n2)cccc3)c4ccccc4
SMILES	CACTVS	3.385	C(Nc1nc(nc2ccccc12)c3ccccc3)c4occc4
SMILES	OpenEye OEToolkits	2.0.5	c1ccc(cc1)c2nc3ccccc3c(n2)NCc4ccco4
Canonical SMILES	CACTVS	3.385	C(Nc1nc(nc2ccccc12)c3ccccc3)c4occc4
Canonical SMILES	OpenEye OEToolkits	2.0.5	c1ccc(cc1)c2nc3ccccc3c(n2)NCc4ccco4
InChI	InChI	1.03	InChI=1S/C19H15N3O/c1-2-7-14(8-3-1)18-21-17-11-5-4-10-16(17)19(22-18)20-13-15-9-6-12-23-15/h1-12H,13H2,(H,20,21,22)
InChIKey	InChI	1.03	AZNLVBWSZDPKAA-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	719250
ChEMBL	CHEMBL332686

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