ethyl 2-[4-(4-chloranyl-3-methyl-phenoxy)butanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[4-(4-chloranyl-3-methyl-phenoxy)butanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[4-(4-chloro-3-methylphenoxy)-1-oxobutyl]amino]-4-(3,4-dimethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-chloro-3-methylphenoxy)butanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H28ClNO6S MolecularWeight: 518.02162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28ClNO6S/c1-5-33-26(30)24-19(17-8-11-21(31-3)22(14-17)32-4)15-35-25(24)28-23(29)7-6-12-34-18-9-10-20(27)16(2)13-18/h8-11,13-15H,5-7,12H2,1-4H3,(H,28,29)