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

Systemtic Name: ethyl 6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C22H22N4O4S/c1-3-30-20(27)18-17(23-21(28)26-19(18)13-7-5-4-6-8-13)12-31-22-24-15-10-9-14(29-2)11-16(15)25-22/h4-11,19H,3,12H2,1-2H3,(H,24,25)(H2,23,26,28)