methyl 2-[2-(furan-2-yl)ethyl]-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-[2-(furan-2-yl)ethyl]-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate Openeye Name: methyl 2-[2-(2-furyl)ethyl]-6-methyl-4-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 2-[2-(2-furanyl)ethyl]-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(furan-2-yl)ethyl]-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate Traditional Name: 2-[2-(2-furyl)ethyl]-6-methyl-4-thioxo-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)N=C(N1)CCC2=CC=CO2)C(=O)OC

Isomeric SMILES

CC1=C(C(=S)N=C(N1)CCC2=CC=CO2)C(=O)OC

InChI

InChI=1S/C13H14N2O3S/c1-8-11(13(16)17-2)12(19)15-10(14-8)6-5-9-4-3-7-18-9/h3-4,7H,5-6H2,1-2H3,(H,14,15,19)