(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl carbamimidothioate hydrochloride

Systemtic Name: (1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl carbamimidothioate hydrochloride Openeye Name: 2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]isothiourea hydrochloride CAS Name: carbamimidothioic acid (1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl ester hydrochloride IUPAC Name: (1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl carbamimidothioate hydrochloride Traditional Name: 2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]isothiourea hydrochloride Formula: C15H15ClN4S2 MolecularWeight: 350.8894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)CSC(=N)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)CSC(=N)N.Cl

InChI

InChI=1S/C15H14N4S2.ClH/c16-15(17)21-10-11-9-19(12-5-2-1-3-6-12)18-14(11)13-7-4-8-20-13;/h1-9H,10H2,(H3,16,17);1H