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

Systemtic Name: ethyl 6-azanyl-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-(2-methylphenyl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-(o-tolyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-2-[[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]methyl]-4-(2-methylphenyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-(2-methylphenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-2-[[(3-cyano-1-pyrindan-2-yl)thio]methyl]-4-(o-tolyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2C)C#N)N)CSC3=NC4=C(CCC4)C=C3C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2C)C#N)N)CSC3=NC4=C(CCC4)C=C3C#N

InChI

InChI=1S/C26H24N4O3S/c1-3-32-26(31)23-21(14-34-25-17(12-27)11-16-8-6-10-20(16)30-25)33-24(29)19(13-28)22(23)18-9-5-4-7-15(18)2/h4-5,7,9,11,22H,3,6,8,10,14,29H2,1-2H3