N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[(2S)-1-[4-(3-chlorophenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-2,5-dimethyl-benzenesulfonamide Formula: C23H30ClN3O3S2 MolecularWeight: 496.0856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N[C@@H](CCSC)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H30ClN3O3S2/c1-17-7-8-18(2)22(15-17)32(29,30)25-21(9-14-31-3)23(28)27-12-10-26(11-13-27)20-6-4-5-19(24)16-20/h4-8,15-16,21,25H,9-14H2,1-3H3/t21-/m0/s1