3-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(4,5,6-trimethyl-2-pyrimidinyl)thio]methyl]benzonitrile IUPAC Name: 3-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(4,5,6-trimethylpyrimidin-2-yl)thio]methyl]benzonitrile Formula: C15H15N3S MolecularWeight: 269.3647

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC2=CC=CC(=C2)C#N)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC2=CC=CC(=C2)C#N)C

InChI

InChI=1S/C15H15N3S/c1-10-11(2)17-15(18-12(10)3)19-9-14-6-4-5-13(7-14)8-16/h4-7H,9H2,1-3H3