2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-2-(4-bromo-2,6-dimethyl-phenoxy)acetamide CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-2-(4-bromo-2,6-dimethylphenoxy)acetamide Traditional Name: N-[4-(4-benzhydrylpiperazino)sulfonylphenyl]-2-(4-bromo-2,6-dimethyl-phenoxy)acetamide Formula: C33H34BrN3O4S MolecularWeight: 648.60976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C)Br

InChI

InChI=1S/C33H34BrN3O4S/c1-24-21-28(34)22-25(2)33(24)41-23-31(38)35-29-13-15-30(16-14-29)42(39,40)37-19-17-36(18-20-37)32(26-9-5-3-6-10-26)27-11-7-4-8-12-27/h3-16,21-22,32H,17-20,23H2,1-2H3,(H,35,38)