ethyl 2-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[4-(2-bromo-4-isopropyl-phenoxy)butanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate CAS Name: 2-[[4-(2-bromo-4-propan-2-ylphenoxy)-1-oxobutyl]amino]-4-(4-chlorophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(2-bromo-4-propan-2-ylphenoxy)butanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylate Traditional Name: 2-[4-(2-bromo-4-isopropyl-phenoxy)butanoylamino]-4-(4-chlorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H27BrClNO4S MolecularWeight: 564.91888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27BrClNO4S/c1-4-32-26(31)24-20(17-7-10-19(28)11-8-17)15-34-25(24)29-23(30)6-5-13-33-22-12-9-18(16(2)3)14-21(22)27/h7-12,14-16H,4-6,13H2,1-3H3,(H,29,30)