N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-[phenethyl(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-2-[phenethyl(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[benzenesulfonyl(phenethyl)amino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]acetamide CAS Name: 2-[benzenesulfonyl(phenethyl)amino]-N-[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[benzenesulfonyl(phenethyl)amino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[besyl(phenethyl)amino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]acetamide Formula: C29H31ClN4O3S MolecularWeight: 551.09944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C29H31ClN4O3S/c1-29(2,3)26-20-27(34(32-26)25-17-11-10-16-24(25)30)31-28(35)21-33(19-18-22-12-6-4-7-13-22)38(36,37)23-14-8-5-9-15-23/h4-17,20H,18-19,21H2,1-3H3,(H,31,35)