2-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(1-p-phenetylbenzimidazol-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C24H20N4O2S MolecularWeight: 428.5062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C24H20N4O2S/c1-2-30-17-13-11-16(12-14-17)28-21-10-6-5-9-20(21)26-24(28)31-15-22-25-19-8-4-3-7-18(19)23(29)27-22/h3-14H,2,15H2,1H3,(H,25,27,29)