ethyl 6-azanyl-5-cyano-2-[(3-cyano-6-thiophen-2-yl-pyridin-2-yl)sulfanylmethyl]-4-(3-phenylmethoxyphenyl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-2-[(3-cyano-6-thiophen-2-yl-pyridin-2-yl)sulfanylmethyl]-4-(3-phenylmethoxyphenyl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(3-benzyloxyphenyl)-5-cyano-2-[[3-cyano-6-(2-thienyl)-2-pyridyl]sulfanylmethyl]-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-2-[[(3-cyano-6-thiophen-2-yl-2-pyridinyl)thio]methyl]-4-(3-phenylmethoxyphenyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-2-[(3-cyano-6-thiophen-2-ylpyridin-2-yl)sulfanylmethyl]-4-(3-phenylmethoxyphenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(3-benzoxyphenyl)-5-cyano-2-[[[3-cyano-6-(2-thienyl)-2-pyridyl]thio]methyl]-4H-pyran-3-carboxylic acid ethyl ester Formula: C33H26N4O4S2 MolecularWeight: 606.71394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC(=CC=C2)OCC3=CC=CC=C3)C#N)N)CSC4=C(C=CC(=N4)C5=CC=CS5)C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC(=CC=C2)OCC3=CC=CC=C3)C#N)N)CSC4=C(C=CC(=N4)C5=CC=CS5)C#N

InChI

InChI=1S/C33H26N4O4S2/c1-2-39-33(38)30-27(20-43-32-23(17-34)13-14-26(37-32)28-12-7-15-42-28)41-31(36)25(18-35)29(30)22-10-6-11-24(16-22)40-19-21-8-4-3-5-9-21/h3-16,29H,2,19-20,36H2,1H3