methyl N-cyano-N'-[phenyl(pyridin-2-yl)methyl]carbamimidothioate

Systemtic Name: methyl N-cyano-N'-[phenyl(pyridin-2-yl)methyl]carbamimidothioate Openeye Name: 1-cyano-2-methyl-3-[phenyl(2-pyridyl)methyl]isothiourea CAS Name: N-cyano-N'-[phenyl(2-pyridinyl)methyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N-cyano-N'-[phenyl(pyridin-2-yl)methyl]carbamimidothioate Traditional Name: 1-cyano-2-methyl-3-[phenyl(2-pyridyl)methyl]isothiourea Formula: C15H14N4S MolecularWeight: 282.36346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC(C1=CC=CC=C1)C2=CC=CC=N2)NC#N

Isomeric SMILES

CSC(=NC(C1=CC=CC=C1)C2=CC=CC=N2)NC#N

InChI

InChI=1S/C15H14N4S/c1-20-15(18-11-16)19-14(12-7-3-2-4-8-12)13-9-5-6-10-17-13/h2-10,14H,1H3,(H,18,19)