methyl 2-[4-(4-ethylphenoxy)butanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[4-(4-ethylphenoxy)butanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[4-(4-ethylphenoxy)butanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[4-(4-ethylphenoxy)-1-oxobutyl]amino]-4-(4-ethylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(4-ethylphenoxy)butanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[4-(4-ethylphenoxy)butanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid methyl 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)OC)NC(=O)CCCOC3=CC=C(C=C3)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)CCCOC3=CC=C(C=C3)CC

InChI

InChI=1S/C26H29NO4S/c1-4-18-8-12-20(13-9-18)22-17-32-25(24(22)26(29)30-3)27-23(28)7-6-16-31-21-14-10-19(5-2)11-15-21/h8-15,17H,4-7,16H2,1-3H3,(H,27,28)