(2R)-1-piperidin-1-yl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propan-1-one

Systemtic Name: (2R)-1-piperidin-1-yl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propan-1-one Openeye Name: (2R)-1-(1-piperidyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propan-1-one CAS Name: (2R)-1-(1-piperidinyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]-1-propanone IUPAC Name: (2R)-1-piperidin-1-yl-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropan-1-one Traditional Name: (2R)-1-piperidino-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propan-1-one Formula: C17H18F3N3OS MolecularWeight: 369.40453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)N1CCCCC1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C17H18F3N3OS/c1-11(15(24)23-9-5-2-6-10-23)25-14-12-7-3-4-8-13(12)21-16(22-14)17(18,19)20/h3-4,7-8,11H,2,5-6,9-10H2,1H3/t11-/m1/s1