1-(4-methylphenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-phenyl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-phenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(2-oxoazepan-1-yl)propyl]-3-phenyl-1-(p-tolyl)pyrazole-4-carboxamide CAS Name: 1-(4-methylphenyl)-N-[3-(2-oxo-1-azepanyl)propyl]-3-phenyl-4-pyrazolecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-[3-(2-oxoazepan-1-yl)propyl]-3-phenylpyrazole-4-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-3-phenyl-1-(p-tolyl)pyrazole-4-carboxamide Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3)C(=O)NCCCN4CCCCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3)C(=O)NCCCN4CCCCCC4=O

InChI

InChI=1S/C26H30N4O2/c1-20-12-14-22(15-13-20)30-19-23(25(28-30)21-9-4-2-5-10-21)26(32)27-16-8-18-29-17-7-3-6-11-24(29)31/h2,4-5,9-10,12-15,19H,3,6-8,11,16-18H2,1H3,(H,27,32)