ethyl 2-methylsulfanyl-6-oxidanylidene-1-(2-oxidanylidene-2-phenylazanyl-ethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-6-oxidanylidene-1-(2-oxidanylidene-2-phenylazanyl-ethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 1-(2-anilino-2-oxo-ethyl)-2-methylsulfanyl-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-(2-anilino-2-oxoethyl)-2-(methylthio)-6-oxo-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-anilino-2-oxoethyl)-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate Traditional Name: 1-(2-anilino-2-keto-ethyl)-6-keto-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC=C2)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=CC=CC=C2)SC

InChI

InChI=1S/C16H17N3O4S/c1-3-23-15(22)12-9-17-16(24-2)19(14(12)21)10-13(20)18-11-7-5-4-6-8-11/h4-9H,3,10H2,1-2H3,(H,18,20)