2-[[5-[2-azanyl-3-cyano-4-(2,4-dimethoxyphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(5-chloranyl-2-methoxy-phenyl)ethanamide

Systemtic Name: 2-[[5-[2-azanyl-3-cyano-4-(2,4-dimethoxyphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(5-chloranyl-2-methoxy-phenyl)ethanamide Openeye Name: 2-[[5-[2-amino-3-cyano-4-(2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(5-chloro-2-methoxy-phenyl)acetamide CAS Name: 2-[[5-[2-amino-3-cyano-4-(2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(5-chloro-2-methoxyphenyl)acetamide IUPAC Name: 2-[[5-[2-amino-3-cyano-4-(2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(5-chloro-2-methoxyphenyl)acetamide Traditional Name: 2-[[5-[2-amino-3-cyano-4-(2,4-dimethoxyphenyl)-5-keto-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(5-chloro-2-methoxy-phenyl)acetamide Formula: C29H27ClN6O5S2 MolecularWeight: 639.14488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NN=C(S4)SCC(=O)NC5=C(C=CC(=C5)Cl)OC)N)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NN=C(S4)SCC(=O)NC5=C(C=CC(=C5)Cl)OC)N)C#N)OC

InChI

InChI=1S/C29H27ClN6O5S2/c1-39-16-8-9-17(23(12-16)41-3)25-18(13-31)27(32)36(20-5-4-6-21(37)26(20)25)28-34-35-29(43-28)42-14-24(38)33-19-11-15(30)7-10-22(19)40-2/h7-12,25H,4-6,14,32H2,1-3H3,(H,33,38)