O4-ethyl O2-propan-2-yl 5-[3-(4-butoxy-3-ethoxy-phenyl)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 5-[3-(4-butoxy-3-ethoxy-phenyl)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 5-[3-(4-butoxy-3-ethoxy-phenyl)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[3-(4-butoxy-3-ethoxyphenyl)-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 5-[3-(4-butoxy-3-ethoxyphenyl)propanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[3-(4-butoxy-3-ethoxy-phenyl)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C27H37NO7S MolecularWeight: 519.65018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C(=O)OCC)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C(=O)OCC)OCC

InChI

InChI=1S/C27H37NO7S/c1-7-10-15-34-20-13-11-19(16-21(20)32-8-2)12-14-22(29)28-25-23(26(30)33-9-3)18(6)24(36-25)27(31)35-17(4)5/h11,13,16-17H,7-10,12,14-15H2,1-6H3,(H,28,29)