2-[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]ethanoylamino]ethanoate

Systemtic Name: 2-[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]ethanoylamino]ethanoate Openeye Name: 2-[[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-1-oxoethyl]amino]acetate IUPAC Name: 2-[[2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[(3-cyano-1-pyrindan-2-yl)thio]acetyl]amino]acetate Formula: C13H12N3O3S- MolecularWeight: 290.31768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(C(=C2)C#N)SCC(=O)NCC(=O)[O-]

Isomeric SMILES

C1CC2=C(C1)N=C(C(=C2)C#N)SCC(=O)NCC(=O)[O-]

InChI

InChI=1S/C13H13N3O3S/c14-5-9-4-8-2-1-3-10(8)16-13(9)20-7-11(17)15-6-12(18)19/h4H,1-3,6-7H2,(H,15,17)(H,18,19)/p-1