N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]pyrazole-4-carboxamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(2,6-dimethylanilino)-2-oxoethyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(2,6-dimethylanilino)-2-keto-ethyl]pyrazole-4-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

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