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

Systemtic Name: methyl 3-aminocarbonyl-2-(2-methylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: methyl 3-carbamoyl-2-(2-methylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-carbamoyl-2-[(2-methyl-1-oxopropyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-carbamoyl-2-(2-methylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-carbamoyl-2-(isobutyrylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid methyl ester Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)OC)C(=O)N

Isomeric SMILES

CC(C)C(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)OC)C(=O)N

InChI

InChI=1S/C14H19N3O4S/c1-7(2)12(19)16-13-10(11(15)18)8-4-5-17(14(20)21-3)6-9(8)22-13/h7H,4-6H2,1-3H3,(H2,15,18)(H,16,19)