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

Systemtic Name: ethyl 5-ethyl-2-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[4-(1-naphthylmethyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[4-(1-naphthalenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[4-(1-naphthylmethyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C26H31N3O3S/c1-3-21-16-23(26(31)32-4-2)25(33-21)27-24(30)18-29-14-12-28(13-15-29)17-20-10-7-9-19-8-5-6-11-22(19)20/h5-11,16H,3-4,12-15,17-18H2,1-2H3,(H,27,30)