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

Systemtic Name: ethyl 2-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(4-hydroxyphenyl)-1-piperazinyl]-1-oxopropyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]propanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[2-[4-(4-hydroxyphenyl)piperazino]propanoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H29N3O4S MolecularWeight: 479.59116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C)N3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C)N3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C26H29N3O4S/c1-3-33-26(32)23-22(19-7-5-4-6-8-19)17-34-25(23)27-24(31)18(2)28-13-15-29(16-14-28)20-9-11-21(30)12-10-20/h4-12,17-18,30H,3,13-16H2,1-2H3,(H,27,31)