5-acetamido-N-[(3-methylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: 5-acetamido-N-[(3-methylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: 5-acetamido-N-(m-tolylmethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: 5-acetamido-N-[(3-methylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide IUPAC Name: 5-acetamido-N-[(3-methylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: 5-acetamido-N-(3-methylbenzyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CNC3=NC=C(C=C23)NC(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CNC3=NC=C(C=C23)NC(=O)C

InChI

InChI=1S/C18H18N4O2/c1-11-4-3-5-13(6-11)8-21-18(24)16-10-20-17-15(16)7-14(9-19-17)22-12(2)23/h3-7,9-10H,8H2,1-2H3,(H,19,20)(H,21,24)(H,22,23)