[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[methyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[methyl-(4-methylphenyl)sulfonylamino]acetic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 2-[methyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[methyl(tosyl)amino]acetic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C16H23N3O6S MolecularWeight: 385.43532

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)CN(C)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H23N3O6S/c1-4-9-17-16(22)18-14(20)11-25-15(21)10-19(3)26(23,24)13-7-5-12(2)6-8-13/h5-8H,4,9-11H2,1-3H3,(H2,17,18,20,22)