ethyl 2-carbamimidoyl-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylate hydrochloride

Systemtic Name: ethyl 2-carbamimidoyl-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylate hydrochloride Openeye Name: ethyl 2-carbamimidoyl-4,5,6,7-tetrahydrobenzothiophene-6-carboxylate hydrochloride CAS Name: 2-carbamimidoyl-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 2-carbamimidoyl-4,5,6,7-tetrahydro-1-benzothiophene-6-carboxylate hydrochloride Traditional Name: 2-amidino-4,5,6,7-tetrahydrobenzothiophene-6-carboxylic acid ethyl ester hydrochloride Formula: C12H17ClN2O2S MolecularWeight: 288.79358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC2=C(C1)SC(=C2)C(=N)N.Cl

Isomeric SMILES

CCOC(=O)C1CCC2=C(C1)SC(=C2)C(=N)N.Cl

InChI

InChI=1S/C12H16N2O2S.ClH/c1-2-16-12(15)8-4-3-7-5-10(11(13)14)17-9(7)6-8;/h5,8H,2-4,6H2,1H3,(H3,13,14);1H