3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]methyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]methyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]methyl]-2-thioxo-1H-quinazolin-4-one Formula: C15H9ClF3N3OS MolecularWeight: 371.76467

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C15H9ClF3N3OS/c16-10-5-8(15(17,18)19)6-20-12(10)7-22-13(23)9-3-1-2-4-11(9)21-14(22)24/h1-6H,7H2,(H,21,24)