G2V
6-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-1-methylindoline
Created: | 2018-05-02 |
Last modified: | 2021-03-13 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 35 |
Chiral Atom Count | 0 |
Bond Count | 38 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | 6-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-1-methylindoline |
Synonyms | 5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-1-methyl-2,3-dihydro-1H-indole |
Systematic Name (OpenEye OEToolkits) | 5-(6,7-dihydro-5~{H}-pyrrolo[1,2-a]imidazol-2-yl)-1-methyl-2,3-dihydroindole |
Formula | C15 H17 N3 |
Molecular Weight | 239.316 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C1CN(c2c1cc(cc2)c4cn3c(CCC3)n4)C |
SMILES | CACTVS | 3.385 | CN1CCc2cc(ccc12)c3cn4CCCc4n3 |
SMILES | OpenEye OEToolkits | 2.0.6 | CN1CCc2c1ccc(c2)c3cn4c(n3)CCC4 |
Canonical SMILES | CACTVS | 3.385 | CN1CCc2cc(ccc12)c3cn4CCCc4n3 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | CN1CCc2c1ccc(c2)c3cn4c(n3)CCC4 |
InChI | InChI | 1.03 | InChI=1S/C15H17N3/c1-17-8-6-12-9-11(4-5-14(12)17)13-10-18-7-2-3-15(18)16-13/h4-5,9-10H,2-3,6-8H2,1H3 |
InChIKey | InChI | 1.03 | GANOSYHSDIPGSR-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 137349384 |
ChEMBL | CHEMBL4281112 |