pyridin-4-ylmethyl N-cyano-N'-ethyl-carbamimidothioate

Systemtic Name: pyridin-4-ylmethyl N-cyano-N'-ethyl-carbamimidothioate Openeye Name: 1-cyano-3-ethyl-2-(4-pyridylmethyl)isothiourea CAS Name: N-cyano-N'-ethylcarbamimidothioic acid pyridin-4-ylmethyl ester IUPAC Name: pyridin-4-ylmethyl N-cyano-N'-ethylcarbamimidothioate Traditional Name: 1-cyano-3-ethyl-2-(4-pyridylmethyl)isothiourea Formula: C10H12N4S MolecularWeight: 220.29408

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC#N)SCC1=CC=NC=C1

Isomeric SMILES

CCN=C(NC#N)SCC1=CC=NC=C1

InChI

InChI=1S/C10H12N4S/c1-2-13-10(14-8-11)15-7-9-3-5-12-6-4-9/h3-6H,2,7H2,1H3,(H,13,14)