2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one

Systemtic Name: 2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Openeye Name: 2-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one CAS Name: 2-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]-3-[3-(trifluoromethyl)phenyl]-4-quinazolinone IUPAC Name: 2-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Traditional Name: 2-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Formula: C25H16F3N3O2S MolecularWeight: 479.47365

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C25H16F3N3O2S/c26-25(27,28)15-6-5-7-16(12-15)31-23(33)18-9-2-4-11-21(18)30-24(31)34-14-22(32)19-13-29-20-10-3-1-8-17(19)20/h1-13,29H,14H2