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

Systemtic Name: ethyl (4R)-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-2-keto-6-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=NC3=C(N2)C=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)CSC2=NC3=C(N2)C=C(C=C3)OC

InChI

InChI=1S/C17H20N4O4S/c1-4-25-15(22)14-9(2)18-16(23)19-13(14)8-26-17-20-11-6-5-10(24-3)7-12(11)21-17/h5-7,9H,4,8H2,1-3H3,(H,20,21)(H2,18,19,23)/t9-/m1/s1