methyl 4-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]carbamoyl]benzoate Openeye Name: methyl 4-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamoyl]benzoate CAS Name: 4-[[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]anilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]carbamoyl]benzoate Traditional Name: 4-[[4-(4-benzhydrylpiperazino)sulfonylphenyl]carbamoyl]benzoic acid methyl ester Formula: C32H31N3O5S MolecularWeight: 569.67064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H31N3O5S/c1-40-32(37)27-14-12-26(13-15-27)31(36)33-28-16-18-29(19-17-28)41(38,39)35-22-20-34(21-23-35)30(24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-19,30H,20-23H2,1H3,(H,33,36)