ethyl 5-(4-chlorophenyl)-3-[2-[4-(2-hydroxyphenyl)piperazin-1-yl]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-3-[2-[4-(2-hydroxyphenyl)piperazin-1-yl]ethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-3-[[2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetyl]amino]thiophene-2-carboxylate CAS Name: 5-(4-chlorophenyl)-3-[[2-[4-(2-hydroxyphenyl)-1-piperazinyl]-1-oxoethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-3-[[2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetyl]amino]thiophene-2-carboxylate Traditional Name: 5-(4-chlorophenyl)-3-[[2-[4-(2-hydroxyphenyl)piperazino]acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C25H26ClN3O4S MolecularWeight: 500.00964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Cl)NC(=O)CN3CCN(CC3)C4=CC=CC=C4O

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Cl)NC(=O)CN3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C25H26ClN3O4S/c1-2-33-25(32)24-19(15-22(34-24)17-7-9-18(26)10-8-17)27-23(31)16-28-11-13-29(14-12-28)20-5-3-4-6-21(20)30/h3-10,15,30H,2,11-14,16H2,1H3,(H,27,31)