2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-phenethylamino]-N-[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-phenethylamino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[brosyl(phenethyl)amino]-N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]acetamide Formula: C29H30BrClN4O3S MolecularWeight: 629.9955

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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=C(C=C3)Br)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=C(C=C3)Br)C4=CC=CC=C4Cl

InChI

InChI=1S/C29H30BrClN4O3S/c1-29(2,3)26-19-27(35(33-26)25-12-8-7-11-24(25)31)32-28(36)20-34(18-17-21-9-5-4-6-10-21)39(37,38)23-15-13-22(30)14-16-23/h4-16,19H,17-18,20H2,1-3H3,(H,32,36)