ethyl 6-[[6-azanyl-5-cyano-3-ethoxycarbonyl-4-(4-methoxyphenyl)-4H-pyran-2-yl]methylsulfanyl]-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 6-[[6-azanyl-5-cyano-3-ethoxycarbonyl-4-(4-methoxyphenyl)-4H-pyran-2-yl]methylsulfanyl]-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 6-[[6-amino-5-cyano-3-ethoxycarbonyl-4-(4-methoxyphenyl)-4H-pyran-2-yl]methylsulfanyl]-5-cyano-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[[6-amino-5-cyano-3-ethoxycarbonyl-4-(4-methoxyphenyl)-4H-pyran-2-yl]methylthio]-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[6-amino-5-cyano-3-ethoxycarbonyl-4-(4-methoxyphenyl)-4H-pyran-2-yl]methylsulfanyl]-5-cyano-2-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[[6-amino-3-carbethoxy-5-cyano-4-(4-methoxyphenyl)-4H-pyran-2-yl]methylthio]-5-cyano-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C31H30N4O6S2 MolecularWeight: 618.7231

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)OC)C#N)N)CSC3=C(C(C(=C(N3)C)C(=O)OCC)C4=CC=CS4)C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)OC)C#N)N)CSC3=C(C(C(=C(N3)C)C(=O)OCC)C4=CC=CS4)C#N

InChI

InChI=1S/C31H30N4O6S2/c1-5-39-30(36)24-17(3)35-29(21(15-33)26(24)23-8-7-13-42-23)43-16-22-27(31(37)40-6-2)25(20(14-32)28(34)41-22)18-9-11-19(38-4)12-10-18/h7-13,25-26,35H,5-6,16,34H2,1-4H3