(2R)-2-methyl-3-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile

Systemtic Name: (2R)-2-methyl-3-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: (2R)-2-methyl-3-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: (2R)-2-methyl-3-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: (2R)-2-methyl-3-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: (2R)-2-methyl-3-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]propionitrile Formula: C14H16N4S MolecularWeight: 272.36864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SC[C@H](C)C#N

InChI

InChI=1S/C14H16N4S/c1-10-4-6-12(7-5-10)13-16-17-14(18(13)3)19-9-11(2)8-15/h4-7,11H,9H2,1-3H3/t11-/m1/s1