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

Systemtic Name: 2-[[5-[2-azanyl-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3,4-dimethylphenyl)ethanamide Openeye Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3,4-dimethylphenyl)acetamide CAS Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(3,4-dimethylphenyl)acetamide IUPAC Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3,4-dimethylphenyl)acetamide Traditional Name: 2-[[5-[2-amino-3-cyano-4-(4-ethylphenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(3,4-dimethylphenyl)acetamide Formula: C32H34N6O2S2 MolecularWeight: 598.78136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H34N6O2S2/c1-6-20-8-10-21(11-9-20)27-23(16-33)29(34)38(24-14-32(4,5)15-25(39)28(24)27)30-36-37-31(42-30)41-17-26(40)35-22-12-7-18(2)19(3)13-22/h7-13,27H,6,14-15,17,34H2,1-5H3,(H,35,40)