ethyl 6-azanyl-2-[[6-tert-butyl-3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanylmethyl]-5-cyano-4-thiophen-2-yl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-2-[[6-tert-butyl-3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanylmethyl]-5-cyano-4-thiophen-2-yl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-2-[[6-tert-butyl-3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanylmethyl]-5-cyano-4-(2-thienyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-2-[[[6-tert-butyl-3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]methyl]-5-cyano-4-thiophen-2-yl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-2-[[6-tert-butyl-3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanylmethyl]-5-cyano-4-thiophen-2-yl-4H-pyran-3-carboxylate Traditional Name: 6-amino-2-[[[6-tert-butyl-3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]methyl]-5-cyano-4-(2-thienyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C35H36N4O4S2 MolecularWeight: 640.81474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CS2)C#N)N)CSC3=NC4=C(CC(CC4)C(C)(C)C)C(=C3C#N)C5=CC=C(C=C5)OC

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=CS2)C#N)N)CSC3=NC4=C(CC(CC4)C(C)(C)C)C(=C3C#N)C5=CC=C(C=C5)OC

InChI

InChI=1S/C35H36N4O4S2/c1-6-42-34(40)31-27(43-32(38)24(17-36)30(31)28-8-7-15-44-28)19-45-33-25(18-37)29(20-9-12-22(41-5)13-10-20)23-16-21(35(2,3)4)11-14-26(23)39-33/h7-10,12-13,15,21,30H,6,11,14,16,19,38H2,1-5H3