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

Systemtic Name: propan-2-yl 6-azanyl-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-(4-methoxycarbonylphenyl)-4H-pyran-3-carboxylate Openeye Name: isopropyl 6-amino-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-(4-methoxycarbonylphenyl)-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-(4-methoxycarbonylphenyl)-4H-pyran-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-amino-5-cyano-2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanylmethyl]-4-(4-methoxycarbonylphenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(4-carbomethoxyphenyl)-5-cyano-2-[[(3-cyano-1-pyrindan-2-yl)thio]methyl]-4H-pyran-3-carboxylic acid isopropyl ester Formula: C28H26N4O5S MolecularWeight: 530.59484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H26N4O5S/c1-15(2)36-28(34)24-22(14-38-26-19(12-29)11-18-5-4-6-21(18)32-26)37-25(31)20(13-30)23(24)16-7-9-17(10-8-16)27(33)35-3/h7-11,15,23H,4-6,14,31H2,1-3H3