O4-ethyl O2-propan-2-yl 3-methyl-5-(3-methylbutanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 3-methyl-5-(3-methylbutanoylamino)thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 3-methyl-5-(3-methylbutanoylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[(3-methyl-1-oxobutyl)amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 3-methyl-5-(3-methylbutanoylamino)thiophene-2,4-dicarboxylate Traditional Name: 5-(isovalerylamino)-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CC(C)C

InChI

InChI=1S/C17H25NO5S/c1-7-22-16(20)13-11(6)14(17(21)23-10(4)5)24-15(13)18-12(19)8-9(2)3/h9-10H,7-8H2,1-6H3,(H,18,19)