methyl 6-(cyanomethylsulfanyl)benzimidazolo[1,2-c]quinazoline-3-carboxylate

Systemtic Name: methyl 6-(cyanomethylsulfanyl)benzimidazolo[1,2-c]quinazoline-3-carboxylate Openeye Name: methyl 6-(cyanomethylsulfanyl)benzimidazolo[1,2-c]quinazoline-3-carboxylate CAS Name: 6-(cyanomethylthio)-3-benzimidazolo[1,2-c]quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 6-(cyanomethylsulfanyl)benzimidazolo[1,2-c]quinazoline-3-carboxylate Traditional Name: 6-(cyanomethylthio)benzimidazolo[1,2-c]quinazoline-3-carboxylic acid methyl ester Formula: C18H12N4O2S MolecularWeight: 348.37848

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC#N

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC#N

InChI

InChI=1S/C18H12N4O2S/c1-24-17(23)11-6-7-12-14(10-11)21-18(25-9-8-19)22-15-5-3-2-4-13(15)20-16(12)22/h2-7,10H,9H2,1H3