ethyl 4-(4-bromophenyl)-2-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[4-(4-chloro-3,5-dimethyl-phenoxy)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[4-(4-chloro-3,5-dimethylphenoxy)-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[4-(4-chloro-3,5-dimethylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[4-(4-chloro-3,5-dimethyl-phenoxy)butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C25H25BrClNO4S MolecularWeight: 550.8923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25BrClNO4S/c1-4-31-25(30)22-20(17-7-9-18(26)10-8-17)14-33-24(22)28-21(29)6-5-11-32-19-12-15(2)23(27)16(3)13-19/h7-10,12-14H,4-6,11H2,1-3H3,(H,28,29)