(2R)-N-(cyclohexylmethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(cyclohexylmethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(cyclohexylmethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: (2R)-N-(cyclohexylmethyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(cyclohexylmethyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: (2R)-N-(cyclohexylmethyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propionamide Formula: C19H22F3N3OS MolecularWeight: 397.45769

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)NCC1CCCCC1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C19H22F3N3OS/c1-12(16(26)23-11-13-7-3-2-4-8-13)27-17-14-9-5-6-10-15(14)24-18(25-17)19(20,21)22/h5-6,9-10,12-13H,2-4,7-8,11H2,1H3,(H,23,26)/t12-/m1/s1