2-chloranyl-N-[1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[3-methylsulfanyl-1-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]propyl]benzamide CAS Name: 2-chloro-N-[1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[3-(methylthio)-1-(4-tosylpiperazine-1-carbonyl)propyl]benzamide Formula: C23H28ClN3O4S2 MolecularWeight: 510.06912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C23H28ClN3O4S2/c1-17-7-9-18(10-8-17)33(30,31)27-14-12-26(13-15-27)23(29)21(11-16-32-2)25-22(28)19-5-3-4-6-20(19)24/h3-10,21H,11-16H2,1-2H3,(H,25,28)