ethyl 4-(4-ethylphenyl)-2-[4-(2-methylphenoxy)butanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-ethylphenyl)-2-[4-(2-methylphenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-ethylphenyl)-2-[4-(2-methylphenoxy)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-[[4-(2-methylphenoxy)-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylphenyl)-2-[4-(2-methylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-2-[4-(2-methylphenoxy)butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C26H29NO4S MolecularWeight: 451.57776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)CCCOC3=CC=CC=C3C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)CCCOC3=CC=CC=C3C

InChI

InChI=1S/C26H29NO4S/c1-4-19-12-14-20(15-13-19)21-17-32-25(24(21)26(29)30-5-2)27-23(28)11-8-16-31-22-10-7-6-9-18(22)3/h6-7,9-10,12-15,17H,4-5,8,11,16H2,1-3H3,(H,27,28)