2-[[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]-1-(2,4,6-trimethylpiperidin-1-yl)ethanone

Systemtic Name: 2-[[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]-1-(2,4,6-trimethylpiperidin-1-yl)ethanone Openeye Name: 2-[[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]-1-(2,4,6-trimethyl-1-piperidyl)ethanone CAS Name: 2-[[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]thio]-1-(2,4,6-trimethyl-1-piperidinyl)ethanone IUPAC Name: 2-[[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]-1-(2,4,6-trimethylpiperidin-1-yl)ethanone Traditional Name: 2-[[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]thio]-1-(2,4,6-trimethylpiperidino)ethanone Formula: C23H26F3N3OS MolecularWeight: 449.53225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C(C1)C)C(=O)CSC2=NC3=C(CCC4=CC=CC=C43)C(=N2)C(F)(F)F)C

Isomeric SMILES

CC1CC(N(C(C1)C)C(=O)CSC2=NC3=C(CCC4=CC=CC=C43)C(=N2)C(F)(F)F)C

InChI

InChI=1S/C23H26F3N3OS/c1-13-10-14(2)29(15(3)11-13)19(30)12-31-22-27-20-17-7-5-4-6-16(17)8-9-18(20)21(28-22)23(24,25)26/h4-7,13-15H,8-12H2,1-3H3