2-chloranyl-N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 2-chloro-N-[(1S)-1-methyl-2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzamide CAS Name: 2-chloro-N-[(2S)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxopropan-2-yl]benzamide IUPAC Name: 2-chloro-N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxopropan-2-yl]benzamide Traditional Name: 2-chloro-N-[(1S)-2-keto-1-methyl-2-(4-tosylpiperazino)ethyl]benzamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)[C@H](C)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-15-7-9-17(10-8-15)30(28,29)25-13-11-24(12-14-25)21(27)16(2)23-20(26)18-5-3-4-6-19(18)22/h3-10,16H,11-14H2,1-2H3,(H,23,26)/t16-/m0/s1