methyl 2-(butanoylamino)-3-(ethoxycarbonylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: methyl 2-(butanoylamino)-3-(ethoxycarbonylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 2-(butanoylamino)-3-(ethoxycarbonylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-[(ethoxycarbonylamino)-oxomethyl]-2-(1-oxobutylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-3-(ethoxycarbonylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-butyramido-3-(carbethoxycarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)OC)C(=O)NC(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)OC)C(=O)NC(=O)OCC

InChI

InChI=1S/C17H23N3O6S/c1-4-6-12(21)18-15-13(14(22)19-16(23)26-5-2)10-7-8-20(17(24)25-3)9-11(10)27-15/h4-9H2,1-3H3,(H,18,21)(H,19,22,23)