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1-[1-benzothiophen-3-yl-(5-ethylthiophen-2-yl)methyl]piperidine-4-carboxylic acid

1-[1-benzothiophen-3-yl-(5-ethylthiophen-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name:1-[1-benzothiophen-3-yl-(5-ethylthiophen-2-yl)methyl]piperidine-4-carboxylic acid
Openeye Name:1-[benzothiophen-3-yl-(5-ethyl-2-thienyl)methyl]piperidine-4-carboxylic acid
CAS Name:1-[1-benzothiophen-3-yl-(5-ethyl-2-thiophenyl)methyl]-4-piperidinecarboxylic acid
IUPAC Name:1-[1-benzothiophen-3-yl-(5-ethylthiophen-2-yl)methyl]piperidine-4-carboxylic acid
Traditional Name:1-[benzothiophen-3-yl-(5-ethyl-2-thienyl)methyl]isonipecotic acid
Formula: C21H23NO2S2
MolecularWeight: 385.54282
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CSC3=CC=CC=C32)N4CCC(CC4)C(=O)O


Isomeric SMILES

CCC1=CC=C(S1)C(C2=CSC3=CC=CC=C32)N4CCC(CC4)C(=O)O


InChI

InChI=1S/C21H23NO2S2/c1-2-15-7-8-19(26-15)20(22-11-9-14(10-12-22)21(23)24)17-13-25-18-6-4-3-5-16(17)18/h3-8,13-14,20H,2,9-12H2,1H3,(H,23,24)


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