2-chloroethyl 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate

Systemtic Name: 2-chloroethyl 3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate Openeye Name: 2-chloroethyl 3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanoate CAS Name: 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate Traditional Name: 3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionic acid 2-chloroethyl ester Formula: C10H13ClN2O3S MolecularWeight: 276.73982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)OCCCl

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)OCCCl

InChI

InChI=1S/C10H13ClN2O3S/c1-6-7(9(15)13-10(17)12-6)2-3-8(14)16-5-4-11/h2-5H2,1H3,(H2,12,13,15,17)