ethyl 5-(carbamimidoylsulfanylmethyl)-1-benzofuran-2-carboxylate hydrochloride

Systemtic Name: ethyl 5-(carbamimidoylsulfanylmethyl)-1-benzofuran-2-carboxylate hydrochloride Openeye Name: ethyl 5-(carbamimidoylsulfanylmethyl)benzofuran-2-carboxylate hydrochloride CAS Name: 5-[(carbamimidoylthio)methyl]-2-benzofurancarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-(carbamimidoylsulfanylmethyl)-1-benzofuran-2-carboxylate hydrochloride Traditional Name: 5-[(amidinothio)methyl]coumarilic acid ethyl ester hydrochloride Formula: C13H15ClN2O3S MolecularWeight: 314.7878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)CSC(=N)N.Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(O1)C=CC(=C2)CSC(=N)N.Cl

InChI

InChI=1S/C13H14N2O3S.ClH/c1-2-17-12(16)11-6-9-5-8(7-19-13(14)15)3-4-10(9)18-11;/h3-6H,2,7H2,1H3,(H3,14,15);1H