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

Systemtic Name: N-[(1R)-2-(4-ethanoylpiperazin-1-yl)-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-ethyl]-3-methyl-benzamide Openeye Name: N-[(1R)-2-(4-acetylpiperazin-1-yl)-2-oxo-1-(p-tolylsulfonyl)ethyl]-3-methyl-benzamide CAS Name: N-[(1R)-2-(4-acetyl-1-piperazinyl)-1-(4-methylphenyl)sulfonyl-2-oxoethyl]-3-methylbenzamide IUPAC Name: N-[(1R)-2-(4-acetylpiperazin-1-yl)-1-(4-methylphenyl)sulfonyl-2-oxoethyl]-3-methylbenzamide Traditional Name: N-[(1R)-2-(4-acetylpiperazino)-2-keto-1-tosyl-ethyl]-3-methyl-benzamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O5S/c1-16-7-9-20(10-8-16)32(30,31)22(24-21(28)19-6-4-5-17(2)15-19)23(29)26-13-11-25(12-14-26)18(3)27/h4-10,15,22H,11-14H2,1-3H3,(H,24,28)/t22-/m1/s1