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

Systemtic Name: 2-[[5-(2-azanyl-3-cyano-5-oxidanylidene-4-pyridin-3-yl-4,6,7,8-tetrahydroquinolin-1-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[[5-[2-amino-3-cyano-5-oxo-4-(3-pyridyl)-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[[5-[2-amino-3-cyano-5-oxo-4-(3-pyridinyl)-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[[5-(2-amino-3-cyano-5-oxo-4-pyridin-3-yl-4,6,7,8-tetrahydroquinolin-1-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[[5-[2-amino-3-cyano-5-keto-4-(3-pyridyl)-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(5-methylisoxazol-3-yl)acetamide Formula: C23H20N8O3S2 MolecularWeight: 520.5867

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSC2=NN=C(S2)N3C4=C(C(C(=C3N)C#N)C5=CN=CC=C5)C(=O)CCC4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSC2=NN=C(S2)N3C4=C(C(C(=C3N)C#N)C5=CN=CC=C5)C(=O)CCC4

InChI

InChI=1S/C23H20N8O3S2/c1-12-8-17(30-34-12)27-18(33)11-35-23-29-28-22(36-23)31-15-5-2-6-16(32)20(15)19(14(9-24)21(31)25)13-4-3-7-26-10-13/h3-4,7-8,10,19H,2,5-6,11,25H2,1H3,(H,27,30,33)