2-(1,3-benzothiazol-2-ylsulfanylmethyl)-7-(trifluoromethyl)-1H-quinazolin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-7-(trifluoromethyl)-1H-quinazolin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-7-(trifluoromethyl)-1H-quinazolin-4-one CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-7-(trifluoromethyl)-1H-quinazolin-4-one Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-7-(trifluoromethyl)-1H-quinazolin-4-one Formula: C17H10F3N3OS2 MolecularWeight: 393.40601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=NC(=O)C4=C(N3)C=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=NC(=O)C4=C(N3)C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C17H10F3N3OS2/c18-17(19,20)9-5-6-10-12(7-9)21-14(23-15(10)24)8-25-16-22-11-3-1-2-4-13(11)26-16/h1-7H,8H2,(H,21,23,24)