N-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[(4-cyanophenyl)carbamoyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[(4-cyanophenyl)carbamoyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-[(4-cyanophenyl)carbamoyl]amino]-N-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]acetamide CAS Name: N-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-2-[[(4-cyanoanilino)-oxomethyl]-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-[(4-cyanophenyl)carbamoyl]amino]-N-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[benzyl-[(4-cyanophenyl)carbamoyl]amino]-N-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]acetamide Formula: C31H32N6O2 MolecularWeight: 520.62478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C31H32N6O2/c1-22-10-16-26(17-11-22)37-28(18-27(35-37)31(2,3)4)34-29(38)21-36(20-24-8-6-5-7-9-24)30(39)33-25-14-12-23(19-32)13-15-25/h5-18H,20-21H2,1-4H3,(H,33,39)(H,34,38)