ethyl 2-(N'-propan-2-ylcarbamimidoyl)thieno[3,2-e][1]benzothiole-4-carboxylate

Systemtic Name: ethyl 2-(N'-propan-2-ylcarbamimidoyl)thieno[3,2-e][1]benzothiole-4-carboxylate Openeye Name: ethyl 2-(N'-isopropylcarbamimidoyl)thieno[3,2-e]benzothiophene-4-carboxylate CAS Name: 2-[amino(propan-2-ylimino)methyl]-4-thieno[3,2-e][1]benzothiolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(N'-propan-2-ylcarbamimidoyl)thieno[3,2-e][1]benzothiole-4-carboxylate Traditional Name: 2-(N'-isopropylamidino)thieno[3,2-e]benzothiophene-4-carboxylic acid ethyl ester Formula: C17H18N2O2S2 MolecularWeight: 346.46702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=CS2)C3=C1SC(=C3)C(=NC(C)C)N

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=CS2)C3=C1SC(=C3)C(=NC(C)C)N

InChI

InChI=1S/C17H18N2O2S2/c1-4-21-17(20)12-8-13-10(5-6-22-13)11-7-14(23-15(11)12)16(18)19-9(2)3/h5-9H,4H2,1-3H3,(H2,18,19)