1-[2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-2-keto-ethyl]isonipecotic acid Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC(CC3)C(=O)O

Isomeric SMILES

C1CC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC(CC3)C(=O)O

InChI

InChI=1S/C16H19N3O3S/c17-8-12-11-2-1-3-13(11)23-15(12)18-14(20)9-19-6-4-10(5-7-19)16(21)22/h10H,1-7,9H2,(H,18,20)(H,21,22)