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

Systemtic Name: methyl 2-(butanoylamino)-3-(methoxycarbonylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 2-(butanoylamino)-3-(methoxycarbonylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-[(methoxycarbonylamino)-oxomethyl]-2-(1-oxobutylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-3-(methoxycarbonylcarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-butyramido-3-(carbomethoxycarbamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C16H21N3O6S MolecularWeight: 383.41944

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O6S/c1-4-5-11(20)17-14-12(13(21)18-15(22)24-2)9-6-7-19(16(23)25-3)8-10(9)26-14/h4-8H2,1-3H3,(H,17,20)(H,18,21,22)