2-[[5-[2-azanyl-4-(3-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[[5-[2-azanyl-4-(3-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[[5-[2-amino-4-(3-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[[5-[2-amino-4-(3-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[[5-[2-amino-4-(3-chlorophenyl)-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[5-[2-amino-4-(3-chlorophenyl)-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(4-fluorophenyl)acetamide Formula: C28H24ClFN6O2S2 MolecularWeight: 595.110563

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=CC=C(C=C4)F)N)C#N)C5=CC(=CC=C5)Cl)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=CC=C(C=C4)F)N)C#N)C5=CC(=CC=C5)Cl)C(=O)C1)C

InChI

InChI=1S/C28H24ClFN6O2S2/c1-28(2)11-20-24(21(37)12-28)23(15-4-3-5-16(29)10-15)19(13-31)25(32)36(20)26-34-35-27(40-26)39-14-22(38)33-18-8-6-17(30)7-9-18/h3-10,23H,11-12,14,32H2,1-2H3,(H,33,38)