[1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: [1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: [1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid [1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(methylcarbamoylamino)-1-oxopropan-2-yl] 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 4-methyl-2-(tosylamino)valeric acid [2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C18H27N3O6S MolecularWeight: 413.48848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O6S/c1-11(2)10-15(17(23)27-13(4)16(22)20-18(24)19-5)21-28(25,26)14-8-6-12(3)7-9-14/h6-9,11,13,15,21H,10H2,1-5H3,(H2,19,20,22,24)