2-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[4-chloro-3-(trifluoromethyl)phenyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[4-chloro-3-(trifluoromethyl)phenyl]thio]methyl]-1H-quinazolin-4-one Formula: C16H10ClF3N2OS MolecularWeight: 370.77661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C16H10ClF3N2OS/c17-12-6-5-9(7-11(12)16(18,19)20)24-8-14-21-13-4-2-1-3-10(13)15(23)22-14/h1-7H,8H2,(H,21,22,23)