5-methyl-1-(3-methylphenyl)-N-(2-oxidanylideneazepan-3-yl)pyrazole-4-carboxamide

Systemtic Name: 5-methyl-1-(3-methylphenyl)-N-(2-oxidanylideneazepan-3-yl)pyrazole-4-carboxamide Openeye Name: 5-methyl-1-(m-tolyl)-N-(2-oxoazepan-3-yl)pyrazole-4-carboxamide CAS Name: 5-methyl-1-(3-methylphenyl)-N-(2-oxo-3-azepanyl)-4-pyrazolecarboxamide IUPAC Name: 5-methyl-1-(3-methylphenyl)-N-(2-oxoazepan-3-yl)pyrazole-4-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-5-methyl-1-(m-tolyl)pyrazole-4-carboxamide Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NC3CCCCNC3=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NC3CCCCNC3=O)C

InChI

InChI=1S/C18H22N4O2/c1-12-6-5-7-14(10-12)22-13(2)15(11-20-22)17(23)21-16-8-3-4-9-19-18(16)24/h5-7,10-11,16H,3-4,8-9H2,1-2H3,(H,19,24)(H,21,23)