6-ethanoyl-2-(3-methylbutanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: 6-ethanoyl-2-(3-methylbutanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: 6-acetyl-2-(3-methylbutanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-acetyl-2-[(3-methyl-1-oxobutyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate IUPAC Name: 6-acetyl-2-(3-methylbutanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-acetyl-2-(isovalerylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Formula: C15H19N2O4S- MolecularWeight: 323.38736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)C)C(=O)[O-]

Isomeric SMILES

CC(C)CC(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)C)C(=O)[O-]

InChI

InChI=1S/C15H20N2O4S/c1-8(2)6-12(19)16-14-13(15(20)21)10-4-5-17(9(3)18)7-11(10)22-14/h8H,4-7H2,1-3H3,(H,16,19)(H,20,21)/p-1