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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)CCCOC3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)CCCOC3=CC=CC(=C3)C

InChI

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