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

Systemtic Name: 3-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-methyl-N-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzamide CAS Name: 3-methyl-N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: 3-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: N-[2-keto-2-(4-tosylpiperazino)ethyl]-3-methyl-benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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