O4-ethyl O2-propan-2-yl 3-methyl-5-[4-(3-methylphenoxy)butanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 3-methyl-5-[4-(3-methylphenoxy)butanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 3-methyl-5-[4-(3-methylphenoxy)butanoylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[4-(3-methylphenoxy)-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-[4-(3-methylphenoxy)butanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[4-(3-methylphenoxy)butanoylamino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C23H29NO6S MolecularWeight: 447.54446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CCCOC2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CCCOC2=CC=CC(=C2)C

InChI

InChI=1S/C23H29NO6S/c1-6-28-22(26)19-16(5)20(23(27)30-14(2)3)31-21(19)24-18(25)11-8-12-29-17-10-7-9-15(4)13-17/h7,9-10,13-14H,6,8,11-12H2,1-5H3,(H,24,25)