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

Systemtic Name: 2-(2-bromanyl-4-butan-2-yl-phenoxy)-N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-2-(2-bromo-4-sec-butyl-phenoxy)acetamide CAS Name: 2-(2-bromo-4-butan-2-ylphenoxy)-N-[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-2-(2-bromo-4-butan-2-ylphenoxy)acetamide Traditional Name: N-[4-(4-benzhydrylpiperazino)sulfonylphenyl]-2-(2-bromo-4-sec-butyl-phenoxy)acetamide Formula: C35H38BrN3O4S MolecularWeight: 676.66292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)Br

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)Br

InChI

InChI=1S/C35H38BrN3O4S/c1-3-26(2)29-14-19-33(32(36)24-29)43-25-34(40)37-30-15-17-31(18-16-30)44(41,42)39-22-20-38(21-23-39)35(27-10-6-4-7-11-27)28-12-8-5-9-13-28/h4-19,24,26,35H,3,20-23,25H2,1-2H3,(H,37,40)