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

Systemtic Name: 2-[[5-(2-azanyl-3-cyano-5-oxidanylidene-4-phenyl-4,6,7,8-tetrahydroquinolin-1-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[2,3,5,6-tetrakis(fluoranyl)phenyl]ethanamide Openeye Name: 2-[[5-(2-amino-3-cyano-5-oxo-4-phenyl-4,6,7,8-tetrahydroquinolin-1-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,3,5,6-tetrafluorophenyl)acetamide CAS Name: 2-[[5-(2-amino-3-cyano-5-oxo-4-phenyl-4,6,7,8-tetrahydroquinolin-1-yl)-1,3,4-thiadiazol-2-yl]thio]-N-(2,3,5,6-tetrafluorophenyl)acetamide IUPAC Name: 2-[[5-(2-amino-3-cyano-5-oxo-4-phenyl-4,6,7,8-tetrahydroquinolin-1-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,3,5,6-tetrafluorophenyl)acetamide Traditional Name: 2-[[5-(2-amino-3-cyano-5-keto-4-phenyl-4,6,7,8-tetrahydroquinolin-1-yl)-1,3,4-thiadiazol-2-yl]thio]-N-(2,3,5,6-tetrafluorophenyl)acetamide Formula: C26H18F4N6O2S2 MolecularWeight: 586.583733

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=C(C(=CC(=C4F)F)F)F)N)C#N)C5=CC=CC=C5)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=C(C(=CC(=C4F)F)F)F)N)C#N)C5=CC=CC=C5)C(=O)C1

InChI

InChI=1S/C26H18F4N6O2S2/c27-14-9-15(28)22(30)23(21(14)29)33-18(38)11-39-26-35-34-25(40-26)36-16-7-4-8-17(37)20(16)19(13(10-31)24(36)32)12-5-2-1-3-6-12/h1-3,5-6,9,19H,4,7-8,11,32H2,(H,33,38)