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

Systemtic Name: ethyl 6-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(1-cyclopropylimidazol-2-yl)thio]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H18N4O3S MolecularWeight: 322.38272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC=CN2C3CC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC=CN2C3CC3

InChI

InChI=1S/C14H18N4O3S/c1-2-21-12(19)10-7-16-13(20)17-11(10)8-22-14-15-5-6-18(14)9-3-4-9/h5-6,9H,2-4,7-8H2,1H3,(H2,16,17,20)