N-[1-[4-(diphenylmethyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[1-[4-(diphenylmethyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[1-(4-benzhydrylpiperazine-1-carbonyl)-3-methylsulfanyl-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[1-[4-(diphenylmethyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[1-(4-benzhydrylpiperazin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1-(4-benzhydrylpiperazine-1-carbonyl)-3-(methylthio)propyl]-4-methyl-benzenesulfonamide Formula: C29H35N3O3S2 MolecularWeight: 537.7365

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H35N3O3S2/c1-23-13-15-26(16-14-23)37(34,35)30-27(17-22-36-2)29(33)32-20-18-31(19-21-32)28(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,27-28,30H,17-22H2,1-2H3