O2-tert-butyl O4-ethyl 5-(butanoylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 5-(butanoylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 5-(butanoylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-(1-oxobutylamino)thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 5-(butanoylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-butyramido-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=C(S1)C(=O)OC(C)(C)C)C)C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=C(C(=C(S1)C(=O)OC(C)(C)C)C)C(=O)OCC

InChI

InChI=1S/C17H25NO5S/c1-7-9-11(19)18-14-12(15(20)22-8-2)10(3)13(24-14)16(21)23-17(4,5)6/h7-9H2,1-6H3,(H,18,19)