pyridin-2-ylmethyl N'-phenylcarbamimidothioate

Systemtic Name: pyridin-2-ylmethyl N'-phenylcarbamimidothioate Openeye Name: 3-phenyl-2-(2-pyridylmethyl)isothiourea CAS Name: N'-phenylcarbamimidothioic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl N'-phenylcarbamimidothioate Traditional Name: 3-phenyl-2-(2-pyridylmethyl)isothiourea Formula: C13H13N3S MolecularWeight: 243.32742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3S/c14-13(16-11-6-2-1-3-7-11)17-10-12-8-4-5-9-15-12/h1-9H,10H2,(H2,14,16)