ethyl 6-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(6-benzimidazolo[1,2-c]quinazolinylthio)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(benzimidazolo[1,2-c]quinazolin-6-ylthio)methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC3=CC=CC=C3C4=NC5=CC=CC=C5N42

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NC3=CC=CC=C3C4=NC5=CC=CC=C5N42

InChI

InChI=1S/C22H19N5O3S/c1-2-30-20(28)14-11-23-21(29)25-17(14)12-31-22-26-15-8-4-3-7-13(15)19-24-16-9-5-6-10-18(16)27(19)22/h3-10H,2,11-12H2,1H3,(H2,23,25,29)