(2R)-3-(4-methylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanenitrile

Systemtic Name: (2R)-3-(4-methylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanenitrile Openeye Name: (2R)-3-(p-tolyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanenitrile CAS Name: (2R)-3-(4-methylphenyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]propanenitrile IUPAC Name: (2R)-3-(4-methylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropanenitrile Traditional Name: (2R)-3-(p-tolyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propionitrile Formula: C19H14F3N3S MolecularWeight: 373.39477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](C#N)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C19H14F3N3S/c1-12-6-8-13(9-7-12)10-14(11-23)26-17-15-4-2-3-5-16(15)24-18(25-17)19(20,21)22/h2-9,14H,10H2,1H3/t14-/m1/s1