3-(2-methoxyethyl)-7-[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(2-methoxyethyl)-7-[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-3-(2-methoxyethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidinyl]-oxomethyl]-3-(2-methoxyethyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-3-(2-methoxyethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-3-(2-methoxyethyl)-2-thioxo-1H-quinazolin-4-one Formula: C24H24F3N3O4S MolecularWeight: 507.52527

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)(C4=CC(=CC=C4)C(F)(F)F)O)NC1=S

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)(C4=CC(=CC=C4)C(F)(F)F)O)NC1=S

InChI

InChI=1S/C24H24F3N3O4S/c1-34-12-11-30-21(32)18-6-5-15(13-19(18)28-22(30)35)20(31)29-9-7-23(33,8-10-29)16-3-2-4-17(14-16)24(25,26)27/h2-6,13-14,33H,7-12H2,1H3,(H,28,35)