ethyl 5-ethyl-2-[2-[4-(phenylmethyl)piperidin-1-yl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[4-(phenylmethyl)piperidin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-benzyl-1-piperidyl)acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-benzylpiperidin-1-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-benzylpiperidino)acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2CCC(CC2)CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2CCC(CC2)CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C23H30N2O3S/c1-3-19-15-20(23(27)28-4-2)22(29-19)24-21(26)16-25-12-10-18(11-13-25)14-17-8-6-5-7-9-17/h5-9,15,18H,3-4,10-14,16H2,1-2H3,(H,24,26)