ethyl 6-[(6-azanylpyridin-3-yl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(6-azanylpyridin-3-yl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(6-amino-3-pyridyl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(6-amino-3-pyridinyl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(6-aminopyridin-3-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(6-amino-3-pyridyl)thio]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C13H16N4O3S MolecularWeight: 308.35614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=CN=C(C=C2)N

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=CN=C(C=C2)N

InChI

InChI=1S/C13H16N4O3S/c1-2-20-12(18)9-6-16-13(19)17-10(9)7-21-8-3-4-11(14)15-5-8/h3-5H,2,6-7H2,1H3,(H2,14,15)(H2,16,17,19)