(2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-methylphenyl)propanenitrile

Systemtic Name: (2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-methylphenyl)propanenitrile Openeye Name: (2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(p-tolyl)propanenitrile CAS Name: (2R)-2-(1,3-benzoxazol-2-ylthio)-3-(4-methylphenyl)propanenitrile IUPAC Name: (2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-methylphenyl)propanenitrile Traditional Name: (2R)-2-(1,3-benzoxazol-2-ylthio)-3-(p-tolyl)propionitrile Formula: C17H14N2OS MolecularWeight: 294.37086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](C#N)SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C17H14N2OS/c1-12-6-8-13(9-7-12)10-14(11-18)21-17-19-15-4-2-3-5-16(15)20-17/h2-9,14H,10H2,1H3/t14-/m1/s1