methyl 2-(3-methylbutanoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-(3-methylbutanoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-(3-methylbutanoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-[(3-methyl-1-oxobutyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(3-methylbutanoylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-(isovalerylamino)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=C(C2=C(S1)CNCC2)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)NC1=C(C2=C(S1)CNCC2)C(=O)OC

InChI

InChI=1S/C14H20N2O3S/c1-8(2)6-11(17)16-13-12(14(18)19-3)9-4-5-15-7-10(9)20-13/h8,15H,4-7H2,1-3H3,(H,16,17)