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

Systemtic Name: ethyl 5-phenyl-3-[2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-phenyl-3-[[2-[4-(2-pyridylmethyl)piperazin-1-yl]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-[4-(2-pyridinylmethyl)-1-piperazinyl]ethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-3-[[2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]acetyl]amino]thiophene-2-carboxylate Traditional Name: 5-phenyl-3-[[2-[4-(2-pyridylmethyl)piperazino]acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C25H28N4O3S MolecularWeight: 464.57982

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)CC4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C25H28N4O3S/c1-2-32-25(31)24-21(16-22(33-24)19-8-4-3-5-9-19)27-23(30)18-29-14-12-28(13-15-29)17-20-10-6-7-11-26-20/h3-11,16H,2,12-15,17-18H2,1H3,(H,27,30)