ethyl 6-[[6-azanyl-5-cyano-3-ethoxycarbonyl-4-(4-fluorophenyl)-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-fluorophenyl)-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-fluorophenyl)-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-fluorophenyl)-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-fluorophenyl)-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-fluorophenyl)-4H-pyran-2-yl]methylthio]-5-cyano-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C30H27FN4O5S2 MolecularWeight: 606.687583

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C30H27FN4O5S2/c1-4-38-29(36)23-16(3)35-28(20(14-33)25(23)22-7-6-12-41-22)42-15-21-26(30(37)39-5-2)24(19(13-32)27(34)40-21)17-8-10-18(31)11-9-17/h6-12,24-25,35H,4-5,15,34H2,1-3H3