methyl (NE)-N-(1-azanylpyridin-2-ylidene)-N'-methyl-carbamimidothioate

Systemtic Name: methyl (NE)-N-(1-azanylpyridin-2-ylidene)-N'-methyl-carbamimidothioate Openeye Name: (1E)-1-(1-amino-2-pyridylidene)-2,3-dimethyl-isothiourea CAS Name: (NE)-N-(1-amino-2-pyridinylidene)-N'-methylcarbamimidothioic acid methyl ester IUPAC Name: methyl (NE)-N-(1-aminopyridin-2-ylidene)-N'-methylcarbamimidothioate Traditional Name: (1E)-1-(1-amino-2-pyridylidene)-2,3-dimethyl-isothiourea Formula: C8H12N4S MolecularWeight: 196.27268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C(N=C1C=CC=CN1N)SC

Isomeric SMILES

CN=C(/N=C/1\C=CC=CN1N)SC

InChI

InChI=1S/C8H12N4S/c1-10-8(13-2)11-7-5-3-4-6-12(7)9/h3-6H,9H2,1-2H3/b10-8?,11-7+