2-[(4-bromophenyl)sulfonyl-butyl-amino]-N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-butyl-amino]-N-[5-methyl-2-(2-methylphenyl)-4-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-butyl-amino]-N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-butylamino]-N-[5-methyl-2-(2-methylphenyl)-4-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-butylamino]-N-[5-methyl-2-(2-methylphenyl)-4-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[brosyl(butyl)amino]-N-[5-methyl-2-(o-tolyl)-4-phenyl-pyrazol-3-yl]acetamide Formula: C29H31BrN4O3S MolecularWeight: 595.55044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCN(CC(=O)NC1=C(C(=NN1C2=CC=CC=C2C)C)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C29H31BrN4O3S/c1-4-5-19-33(38(36,37)25-17-15-24(30)16-18-25)20-27(35)31-29-28(23-12-7-6-8-13-23)22(3)32-34(29)26-14-10-9-11-21(26)2/h6-18H,4-5,19-20H2,1-3H3,(H,31,35)