(2R)-3-(4-methylphenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanenitrile

Systemtic Name: (2R)-3-(4-methylphenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanenitrile Openeye Name: (2R)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-3-(p-tolyl)propanenitrile CAS Name: (2R)-3-(4-methylphenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanenitrile IUPAC Name: (2R)-3-(4-methylphenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanenitrile Traditional Name: (2R)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]-3-(p-tolyl)propionitrile Formula: C21H19N3S MolecularWeight: 345.46066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC2=NC(=CC(=N2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](C#N)SC2=NC(=CC(=N2)C)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3S/c1-15-8-10-17(11-9-15)13-19(14-22)25-21-23-16(2)12-20(24-21)18-6-4-3-5-7-18/h3-12,19H,13H2,1-2H3/t19-/m1/s1