ethyl (4R)-6-azanyl-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-phenyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl (4R)-6-azanyl-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-phenyl-4H-pyran-3-carboxylate Openeye Name: ethyl (4R)-6-amino-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-phenyl-4H-pyran-3-carboxylate CAS Name: (4R)-6-amino-5-cyano-2-[[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]methyl]-4-phenyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-amino-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-phenyl-4H-pyran-3-carboxylate Traditional Name: (4R)-6-amino-5-cyano-2-[[(3-cyano-1-pyrindan-2-yl)thio]methyl]-4-phenyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2)C#N)N)CSC3=NC4=C(CCC4)C=C3C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C([C@H]1C2=CC=CC=C2)C#N)N)CSC3=NC4=C(CCC4)C=C3C#N

InChI

InChI=1S/C25H22N4O3S/c1-2-31-25(30)22-20(14-33-24-17(12-26)11-16-9-6-10-19(16)29-24)32-23(28)18(13-27)21(22)15-7-4-3-5-8-15/h3-5,7-8,11,21H,2,6,9-10,14,28H2,1H3/t21-/m1/s1