ethyl 4-(methoxymethyl)-6-methyl-3-(3-methylbutanoylamino)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 4-(methoxymethyl)-6-methyl-3-(3-methylbutanoylamino)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 4-(methoxymethyl)-6-methyl-3-(3-methylbutanoylamino)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 4-(methoxymethyl)-6-methyl-3-[(3-methyl-1-oxobutyl)amino]-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(methoxymethyl)-6-methyl-3-(3-methylbutanoylamino)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-(isovalerylamino)-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2COC)C)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2COC)C)NC(=O)CC(C)C

InChI

InChI=1S/C18H24N2O4S/c1-6-24-18(22)16-15(20-13(21)7-10(2)3)14-12(9-23-5)8-11(4)19-17(14)25-16/h8,10H,6-7,9H2,1-5H3,(H,20,21)