methyl N'-(3-pyridin-2-yl-3-thiophen-2-yl-propyl)carbamimidothioate

Systemtic Name: methyl N'-(3-pyridin-2-yl-3-thiophen-2-yl-propyl)carbamimidothioate Openeye Name: 2-methyl-3-[3-(2-pyridyl)-3-(2-thienyl)propyl]isothiourea CAS Name: N'-[3-(2-pyridinyl)-3-thiophen-2-ylpropyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(3-pyridin-2-yl-3-thiophen-2-ylpropyl)carbamimidothioate Traditional Name: 2-methyl-3-[3-(2-pyridyl)-3-(2-thienyl)propyl]isothiourea Formula: C14H17N3S2 MolecularWeight: 291.43488

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCC(C1=CC=CC=N1)C2=CC=CS2)N

Isomeric SMILES

CSC(=NCCC(C1=CC=CC=N1)C2=CC=CS2)N

InChI

InChI=1S/C14H17N3S2/c1-18-14(15)17-9-7-11(13-6-4-10-19-13)12-5-2-3-8-16-12/h2-6,8,10-11H,7,9H2,1H3,(H2,15,17)