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

Systemtic Name: (2R)-3-(4-methylphenyl)-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Openeye Name: (2R)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-(p-tolyl)propanenitrile CAS Name: (2R)-3-(4-methylphenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]propanenitrile IUPAC Name: (2R)-3-(4-methylphenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Traditional Name: (2R)-2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]-3-(p-tolyl)propionitrile Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SC(CC2=CC=C(C=C2)C)C#N

Isomeric SMILES

CCCN1C(=O)NN=C1S[C@H](CC2=CC=C(C=C2)C)C#N

InChI

InChI=1S/C15H18N4OS/c1-3-8-19-14(20)17-18-15(19)21-13(10-16)9-12-6-4-11(2)5-7-12/h4-7,13H,3,8-9H2,1-2H3,(H,17,20)/t13-/m1/s1