methyl 2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C25H20N4O4S MolecularWeight: 472.5157

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=NC(=O)C5=C(N4)C=C(C=C5)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=NC(=O)C5=C(N4)C=C(C=C5)C(=O)OC

InChI

InChI=1S/C25H20N4O4S/c1-32-17-10-8-16(9-11-17)29-21-6-4-3-5-19(21)27-25(29)34-14-22-26-20-13-15(24(31)33-2)7-12-18(20)23(30)28-22/h3-13H,14H2,1-2H3,(H,26,28,30)