3-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-quinazolin-4-one CAS Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylquinazolin-4-one Traditional Name: 3-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(2-keto-2-pyrrolidino-ethyl)thio]quinazolin-4-one Formula: C21H17ClF3N3O2S MolecularWeight: 467.89179

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C21H17ClF3N3O2S/c22-15-8-7-13(21(23,24)25)11-17(15)28-19(30)14-5-1-2-6-16(14)26-20(28)31-12-18(29)27-9-3-4-10-27/h1-2,5-8,11H,3-4,9-10,12H2