7-pyrrolidin-1-ylcarbonyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one

Systemtic Name: 7-pyrrolidin-1-ylcarbonyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one Openeye Name: 7-(pyrrolidine-1-carbonyl)-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one CAS Name: 7-[oxo(1-pyrrolidinyl)methyl]-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one IUPAC Name: 7-(pyrrolidine-1-carbonyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one Traditional Name: 7-(pyrrolidine-1-carbonyl)-2-thioxo-3-[3-(trifluoromethyl)phenyl]-1H-quinazolin-4-one Formula: C20H16F3N3O2S MolecularWeight: 419.42015

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H16F3N3O2S/c21-20(22,23)13-4-3-5-14(11-13)26-18(28)15-7-6-12(10-16(15)24-19(26)29)17(27)25-8-1-2-9-25/h3-7,10-11H,1-2,8-9H2,(H,24,29)