ethyl 2-methylsulfanyl-4-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-[2-oxo-2-(thiazol-2-ylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-[[2-keto-2-(thiazol-2-ylamino)ethyl]thio]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C13H14N4O3S3 MolecularWeight: 370.47026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1SCC(=O)NC2=NC=CS2)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1SCC(=O)NC2=NC=CS2)SC

InChI

InChI=1S/C13H14N4O3S3/c1-3-20-11(19)8-6-15-12(21-2)17-10(8)23-7-9(18)16-13-14-4-5-22-13/h4-6H,3,7H2,1-2H3,(H,14,16,18)