(phenylmethyl) 2-[(3-cyano-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(3-cyano-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]ethanoate Openeye Name: benzyl 2-[[3-cyano-4-(2-thienyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl]acetate CAS Name: 2-[(3-cyano-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(3-cyano-4-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetate Traditional Name: 2-[[3-cyano-4-(2-thienyl)-1-pyrindan-2-yl]thio]acetic acid benzyl ester Formula: C22H18N2O2S2 MolecularWeight: 406.52052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(C(=C2C3=CC=CS3)C#N)SCC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)N=C(C(=C2C3=CC=CS3)C#N)SCC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H18N2O2S2/c23-12-17-21(19-10-5-11-27-19)16-8-4-9-18(16)24-22(17)28-14-20(25)26-13-15-6-2-1-3-7-15/h1-3,5-7,10-11H,4,8-9,13-14H2