2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-(trifluoromethyl)-1H-quinazolin-4-one

Systemtic Name: 2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Openeye Name: 2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-(trifluoromethyl)-1H-quinazolin-4-one CAS Name: 2-[[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one IUPAC Name: 2-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Traditional Name: 2-[[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Formula: C20H17F3N4O2S MolecularWeight: 434.43479

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)C(F)(F)F

Isomeric SMILES

COCCN1C2=CC=CC=C2N=C1SCC3=NC(=O)C4=C(N3)C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H17F3N4O2S/c1-29-9-8-27-16-5-3-2-4-14(16)25-19(27)30-11-17-24-15-10-12(20(21,22)23)6-7-13(15)18(28)26-17/h2-7,10H,8-9,11H2,1H3,(H,24,26,28)