4-[[4-(aminomethyl)cyclohexyl]carbonylamino]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: 4-[[4-(aminomethyl)cyclohexyl]carbonylamino]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: 4-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: 4-[[[4-(aminomethyl)cyclohexyl]-oxomethyl]amino]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide IUPAC Name: 4-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: 4-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)C(=O)NC2=C3C(=CNC3=NC=C2)C(=O)N

Isomeric SMILES

C1CC(CCC1CN)C(=O)NC2=C3C(=CNC3=NC=C2)C(=O)N

InChI

InChI=1S/C16H21N5O2/c17-7-9-1-3-10(4-2-9)16(23)21-12-5-6-19-15-13(12)11(8-20-15)14(18)22/h5-6,8-10H,1-4,7,17H2,(H2,18,22)(H2,19,20,21,23)