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

Systemtic Name: 5-(furan-2-yl)-2-(4-methylphenyl)-N-(2-oxidanylideneazepan-3-yl)pyrazole-3-carboxamide Openeye Name: 5-(2-furyl)-N-(2-oxoazepan-3-yl)-2-(p-tolyl)pyrazole-3-carboxamide CAS Name: 5-(2-furanyl)-2-(4-methylphenyl)-N-(2-oxo-3-azepanyl)-3-pyrazolecarboxamide IUPAC Name: 5-(furan-2-yl)-2-(4-methylphenyl)-N-(2-oxoazepan-3-yl)pyrazole-3-carboxamide Traditional Name: 5-(2-furyl)-N-(2-ketoazepan-3-yl)-2-(p-tolyl)pyrazole-3-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CO3)C(=O)NC4CCCCNC4=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CO3)C(=O)NC4CCCCNC4=O

InChI

InChI=1S/C21H22N4O3/c1-14-7-9-15(10-8-14)25-18(13-17(24-25)19-6-4-12-28-19)21(27)23-16-5-2-3-11-22-20(16)26/h4,6-10,12-13,16H,2-3,5,11H2,1H3,(H,22,26)(H,23,27)