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

Systemtic Name: ethyl 6-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(6-chloro-1H-benzimidazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(6-chloro-1H-benzimidazol-2-yl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(6-chloro-1H-benzimidazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(6-chloro-1H-benzimidazol-2-yl)thio]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H15ClN4O3S MolecularWeight: 366.8226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C15H15ClN4O3S/c1-2-23-13(21)9-6-17-14(22)18-12(9)7-24-15-19-10-4-3-8(16)5-11(10)20-15/h3-5H,2,6-7H2,1H3,(H,19,20)(H2,17,18,22)