3-(2-methylpropyl)-2-sulfanylidene-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-1H-quinazolin-4-one

Systemtic Name: 3-(2-methylpropyl)-2-sulfanylidene-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-1H-quinazolin-4-one Openeye Name: 3-isobutyl-2-thioxo-7-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinazolin-4-one CAS Name: 3-(2-methylpropyl)-7-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(2-methylpropyl)-2-sulfanylidene-7-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinazolin-4-one Traditional Name: 3-isobutyl-2-thioxo-7-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinazolin-4-one Formula: C24H25F3N4O2S MolecularWeight: 490.54111

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)NC1=S

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)NC1=S

InChI

InChI=1S/C24H25F3N4O2S/c1-15(2)14-31-22(33)19-7-6-16(12-20(19)28-23(31)34)21(32)30-10-8-29(9-11-30)18-5-3-4-17(13-18)24(25,26)27/h3-7,12-13,15H,8-11,14H2,1-2H3,(H,28,34)