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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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