N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[(1S)-2-methyl-1-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]propyl]benzamide CAS Name: N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxobutan-2-yl]benzamide IUPAC Name: N-[(2S)-3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxobutan-2-yl]benzamide Traditional Name: N-[(1S)-2-methyl-1-(4-tosylpiperazine-1-carbonyl)propyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4S/c1-17(2)21(24-22(27)19-7-5-4-6-8-19)23(28)25-13-15-26(16-14-25)31(29,30)20-11-9-18(3)10-12-20/h4-12,17,21H,13-16H2,1-3H3,(H,24,27)/t21-/m0/s1