methyl 2-[1-[(4-methylphenyl)sulfonylcarbamoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[(4-methylphenyl)sulfonylcarbamoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[3-oxo-1-(p-tolylsulfonylcarbamoyl)piperazin-2-yl]acetate CAS Name: 2-[1-[[(4-methylphenyl)sulfonylamino]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[(4-methylphenyl)sulfonylcarbamoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(tosylcarbamoyl)piperazin-2-yl]acetic acid methyl ester Formula: C15H19N3O6S MolecularWeight: 369.39286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N2CCNC(=O)C2CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N2CCNC(=O)C2CC(=O)OC

InChI

InChI=1S/C15H19N3O6S/c1-10-3-5-11(6-4-10)25(22,23)17-15(21)18-8-7-16-14(20)12(18)9-13(19)24-2/h3-6,12H,7-9H2,1-2H3,(H,16,20)(H,17,21)