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

Systemtic Name: ethyl 3-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[4-(4-hydroxyphenyl)-1-piperazinyl]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[4-(4-hydroxyphenyl)piperazino]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O4S/c1-2-32-25(31)24-21(16-22(33-24)18-6-4-3-5-7-18)26-23(30)17-27-12-14-28(15-13-27)19-8-10-20(29)11-9-19/h3-11,16,29H,2,12-15,17H2,1H3,(H,26,30)