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

Systemtic Name: 2-[[5-[2-azanyl-3-cyano-4-(4-ethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,4-dichlorophenyl)ethanamide Openeye Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,4-dichlorophenyl)acetamide CAS Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(2,4-dichlorophenyl)acetamide IUPAC Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,4-dichlorophenyl)acetamide Traditional Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-5-keto-4,6,7,8-tetrahydroquinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(2,4-dichlorophenyl)acetamide Formula: C28H24Cl2N6O2S2 MolecularWeight: 611.56516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NN=C(S4)SCC(=O)NC5=C(C=C(C=C5)Cl)Cl)N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NN=C(S4)SCC(=O)NC5=C(C=C(C=C5)Cl)Cl)N)C#N

InChI

InChI=1S/C28H24Cl2N6O2S2/c1-2-15-6-8-16(9-7-15)24-18(13-31)26(32)36(21-4-3-5-22(37)25(21)24)27-34-35-28(40-27)39-14-23(38)33-20-11-10-17(29)12-19(20)30/h6-12,24H,2-5,14,32H2,1H3,(H,33,38)