N-[(3-acetamidophenyl)methyl]-3-(4-methylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[(3-acetamidophenyl)methyl]-3-(4-methylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[(3-acetamidophenyl)methyl]-1-benzyl-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: N-[(3-acetamidophenyl)methyl]-3-(4-methylphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[(3-acetamidophenyl)methyl]-1-benzyl-3-(4-methylphenyl)pyrazole-4-carboxamide Traditional Name: N-(3-acetamidobenzyl)-1-benzyl-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)NCC3=CC(=CC=C3)NC(=O)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCC3=CC(=CC=C3)NC(=O)C)CC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2/c1-19-11-13-23(14-12-19)26-25(18-31(30-26)17-21-7-4-3-5-8-21)27(33)28-16-22-9-6-10-24(15-22)29-20(2)32/h3-15,18H,16-17H2,1-2H3,(H,28,33)(H,29,32)