6-isothiocyanato-2,3-dimethyl-2H-pyridine-3-carbonitrile

Systemtic Name: 6-isothiocyanato-2,3-dimethyl-2H-pyridine-3-carbonitrile Openeye Name: 6-isothiocyanato-2,3-dimethyl-2H-pyridine-3-carbonitrile CAS Name: 6-isothiocyanato-2,3-dimethyl-2H-pyridine-3-carbonitrile IUPAC Name: 6-isothiocyanato-2,3-dimethyl-2H-pyridine-3-carbonitrile Traditional Name: 6-isothiocyanato-2,3-dimethyl-2H-pyridine-3-carbonitrile Formula: C9H9N3S MolecularWeight: 191.25286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C=CC(=N1)N=C=S)(C)C#N

Isomeric SMILES

CC1C(C=CC(=N1)N=C=S)(C)C#N

InChI

InChI=1S/C9H9N3S/c1-7-9(2,5-10)4-3-8(12-7)11-6-13/h3-4,7H,1-2H3