methyl 6-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate

Systemtic Name: methyl 6-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate Openeye Name: methyl 6-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate CAS Name: 6-[(5-acetyl-2-methoxyphenyl)methylthio]-3-benzimidazolo[1,2-c]quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]benzimidazolo[1,2-c]quinazoline-3-carboxylate Traditional Name: 6-[(5-acetyl-2-methoxy-benzyl)thio]benzimidazolo[1,2-c]quinazoline-3-carboxylic acid methyl ester Formula: C26H21N3O4S MolecularWeight: 471.52764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C4=NC5=CC=CC=C5N42

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C4=NC5=CC=CC=C5N42

InChI

InChI=1S/C26H21N3O4S/c1-15(30)16-9-11-23(32-2)18(12-16)14-34-26-28-21-13-17(25(31)33-3)8-10-19(21)24-27-20-6-4-5-7-22(20)29(24)26/h4-13H,14H2,1-3H3