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

Systemtic Name: N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: N-[(1S)-1-methyl-2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzamide CAS Name: N-[(2S)-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxopropan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1-oxopropan-2-yl]benzamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(4-tosylpiperazino)ethyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

Click to see the large picture

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=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S/c1-16-8-10-19(11-9-16)29(27,28)24-14-12-23(13-15-24)21(26)17(2)22-20(25)18-6-4-3-5-7-18/h3-11,17H,12-15H2,1-2H3,(H,22,25)/t17-/m0/s1