(2R)-2-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]pentanedinitrile

Systemtic Name: (2R)-2-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]pentanedinitrile Openeye Name: (2R)-2-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]pentanedinitrile CAS Name: (2R)-2-[[(4,5,6-trimethyl-2-pyrimidinyl)thio]methyl]pentanedinitrile IUPAC Name: (2R)-2-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]pentanedinitrile Traditional Name: (2R)-2-[[(4,5,6-trimethylpyrimidin-2-yl)thio]methyl]glutaronitrile Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(CCC#N)C#N)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SC[C@H](CCC#N)C#N)C

InChI

InChI=1S/C13H16N4S/c1-9-10(2)16-13(17-11(9)3)18-8-12(7-15)5-4-6-14/h12H,4-5,8H2,1-3H3/t12-/m1/s1