pyridin-2-ylmethyl N'-(4-methoxyphenyl)carbamimidothioate hydrochloride

Systemtic Name: pyridin-2-ylmethyl N'-(4-methoxyphenyl)carbamimidothioate hydrochloride Openeye Name: 3-(4-methoxyphenyl)-2-(2-pyridylmethyl)isothiourea hydrochloride CAS Name: N'-(4-methoxyphenyl)carbamimidothioic acid 2-pyridinylmethyl ester hydrochloride IUPAC Name: pyridin-2-ylmethyl N'-(4-methoxyphenyl)carbamimidothioate hydrochloride Traditional Name: 3-(4-methoxyphenyl)-2-(2-pyridylmethyl)isothiourea hydrochloride Formula: C14H16ClN3OS MolecularWeight: 309.81434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C(N)SCC2=CC=CC=N2.Cl

Isomeric SMILES

COC1=CC=C(C=C1)N=C(N)SCC2=CC=CC=N2.Cl

InChI

InChI=1S/C14H15N3OS.ClH/c1-18-13-7-5-11(6-8-13)17-14(15)19-10-12-4-2-3-9-16-12;/h2-9H,10H2,1H3,(H2,15,17);1H