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

Systemtic Name: 3-(4-methylphenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(benzylamino)-2-oxo-ethyl]-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: 3-(4-methylphenyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(benzylamino)-2-oxoethyl]-3-(4-methylphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(benzylamino)-2-keto-ethyl]-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)NCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H26N4O2/c1-20-12-14-23(15-13-20)26-24(19-31(30-26)18-22-10-6-3-7-11-22)27(33)29-17-25(32)28-16-21-8-4-2-5-9-21/h2-15,19H,16-18H2,1H3,(H,28,32)(H,29,33)