4-(5-cyanopyridin-2-yl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(5-cyanopyridin-2-yl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(5-cyano-2-pyridyl)-N-(o-tolyl)-1,4-diazepane-1-carboxamide CAS Name: 4-(5-cyano-2-pyridinyl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(5-cyanopyridin-2-yl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(5-cyano-2-pyridyl)-N-(o-tolyl)-1,4-diazepane-1-carboxamide Formula: C19H21N5O MolecularWeight: 335.40294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)N2CCCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)N2CCCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C19H21N5O/c1-15-5-2-3-6-17(15)22-19(25)24-10-4-9-23(11-12-24)18-8-7-16(13-20)14-21-18/h2-3,5-8,14H,4,9-12H2,1H3,(H,22,25)