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

Systemtic Name: N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-[(phenylmethyl)-(2-phenylsulfanylethanoyl)amino]ethanamide Openeye Name: 2-[benzyl-(2-phenylsulfanylacetyl)amino]-N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]acetamide CAS Name: N-[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]-2-[[1-oxo-2-(phenylthio)ethyl]-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-(2-phenylsulfanylacetyl)amino]-N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[benzyl-[2-(phenylthio)acetyl]amino]-N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]acetamide Formula: C31H34N4O2S MolecularWeight: 526.69226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CC3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C31H34N4O2S/c1-23-13-11-12-18-26(23)35-28(19-27(33-35)31(2,3)4)32-29(36)21-34(20-24-14-7-5-8-15-24)30(37)22-38-25-16-9-6-10-17-25/h5-19H,20-22H2,1-4H3,(H,32,36)