5-methyl-1-(3-methylphenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-1-(3-methylphenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]pyrazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-5-methyl-1-(m-tolyl)pyrazole-4-carboxamide CAS Name: 5-methyl-1-(3-methylphenyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4-pyrazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-5-methyl-1-(3-methylphenyl)pyrazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-5-methyl-1-(m-tolyl)pyrazole-4-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O2/c1-15-7-6-10-18(11-15)25-16(2)19(13-24-25)21(27)23-14-20(26)22-12-17-8-4-3-5-9-17/h3-11,13H,12,14H2,1-2H3,(H,22,26)(H,23,27)