2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)-3-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)-3-(4-methoxyphenyl)quinazolin-4-one Formula: C23H18N4O2S MolecularWeight: 414.47962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5N4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H18N4O2S/c1-29-16-12-10-15(11-13-16)27-22(28)17-6-2-3-7-18(17)26-23(27)30-14-21-24-19-8-4-5-9-20(19)25-21/h2-13H,14H2,1H3,(H,24,25)