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

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[4-(4-chloranyl-3-methyl-phenoxy)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[4-(4-chloro-3-methylphenoxy)-1-oxobutyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[4-(4-chloro-3-methylphenoxy)butanoylamino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C24H23BrClNO4S MolecularWeight: 536.86572

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)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C24H23BrClNO4S/c1-3-30-24(29)22-19(16-6-8-17(25)9-7-16)14-32-23(22)27-21(28)5-4-12-31-18-10-11-20(26)15(2)13-18/h6-11,13-14H,3-5,12H2,1-2H3,(H,27,28)