pyridin-2-ylmethyl N-cyano-N'-phenyl-carbamimidothioate

Systemtic Name: pyridin-2-ylmethyl N-cyano-N'-phenyl-carbamimidothioate Openeye Name: 1-cyano-3-phenyl-2-(2-pyridylmethyl)isothiourea CAS Name: N-cyano-N'-phenylcarbamimidothioic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl N-cyano-N'-phenylcarbamimidothioate Traditional Name: 1-cyano-3-phenyl-2-(2-pyridylmethyl)isothiourea Formula: C14H12N4S MolecularWeight: 268.33688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=C(NC#N)SCC2=CC=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)N=C(NC#N)SCC2=CC=CC=N2

InChI

InChI=1S/C14H12N4S/c15-11-17-14(18-12-6-2-1-3-7-12)19-10-13-8-4-5-9-16-13/h1-9H,10H2,(H,17,18)