ethyl 1-[2-[(4-methylphenyl)sulfonylamino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-[2-[(4-methylphenyl)sulfonylamino]-2-oxidanylidene-ethyl]-2-methylsulfanyl-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-6-oxo-1-[2-oxo-2-(p-tolylsulfonylamino)ethyl]pyrimidine-5-carboxylate CAS Name: 1-[2-[(4-methylphenyl)sulfonylamino]-2-oxoethyl]-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-methylphenyl)sulfonylamino]-2-oxoethyl]-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 6-keto-1-[2-keto-2-(tosylamino)ethyl]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C17H19N3O6S2 MolecularWeight: 425.47926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NS(=O)(=O)C2=CC=C(C=C2)C)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NS(=O)(=O)C2=CC=C(C=C2)C)SC

InChI

InChI=1S/C17H19N3O6S2/c1-4-26-16(23)13-9-18-17(27-3)20(15(13)22)10-14(21)19-28(24,25)12-7-5-11(2)6-8-12/h5-9H,4,10H2,1-3H3,(H,19,21)