methyl 6-[(4-chlorophenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate

Systemtic Name: methyl 6-[(4-chlorophenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate Openeye Name: methyl 6-[(4-chlorophenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate CAS Name: 6-[(4-chlorophenyl)methylthio]-3-benzimidazolo[1,2-c]quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(4-chlorophenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate Traditional Name: 6-[(4-chlorobenzyl)thio]benzimidazolo[1,2-c]quinazoline-3-carboxylic acid methyl ester Formula: C23H16ClN3O2S MolecularWeight: 433.91004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC5=CC=C(C=C5)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=N2)SCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H16ClN3O2S/c1-29-22(28)15-8-11-17-19(12-15)26-23(30-13-14-6-9-16(24)10-7-14)27-20-5-3-2-4-18(20)25-21(17)27/h2-12H,13H2,1H3