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

Systemtic Name: 2-[[5-[2-azanyl-3-cyano-4-(2-fluorophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[[5-[2-amino-3-cyano-4-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-thiazol-2-yl-acetamide CAS Name: 2-[[5-[2-amino-3-cyano-4-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(2-thiazolyl)acetamide IUPAC Name: 2-[[5-[2-amino-3-cyano-4-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[[5-[2-amino-3-cyano-4-(2-fluorophenyl)-5-keto-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-thiazol-2-yl-acetamide Formula: C23H18FN7O2S3 MolecularWeight: 539.628123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=NC=CS4)N)C#N)C5=CC=CC=C5F)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=NC=CS4)N)C#N)C5=CC=CC=C5F)C(=O)C1

InChI

InChI=1S/C23H18FN7O2S3/c24-14-5-2-1-4-12(14)18-13(10-25)20(26)31(15-6-3-7-16(32)19(15)18)22-29-30-23(36-22)35-11-17(33)28-21-27-8-9-34-21/h1-2,4-5,8-9,18H,3,6-7,11,26H2,(H,27,28,33)