N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-1-phenyl-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-3-(4-methylphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-3-(4-methylphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-1-phenyl-3-(p-tolyl)pyrazole-4-carboxamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCC(=O)NC3=C(C=CC=C3C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCC(=O)NC3=C(C=CC=C3C)C)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2/c1-18-12-14-21(15-13-18)26-23(17-31(30-26)22-10-5-4-6-11-22)27(33)28-16-24(32)29-25-19(2)8-7-9-20(25)3/h4-15,17H,16H2,1-3H3,(H,28,33)(H,29,32)