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-(3,4-dimethylphenyl)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-(3,4-dimethylphenyl)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-(3,4-dimethylphenyl)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-(3,4-dimethylphenyl)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-(3,4-dimethylphenyl)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-(3,4-dimethylphenyl)acetamide Formula: C30H29ClN6O2S2 MolecularWeight: 605.17326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(S2)N3C4=C(C(C(=C3N)C#N)C5=CC(=CC=C5)Cl)C(=O)CC(C4)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(S2)N3C4=C(C(C(=C3N)C#N)C5=CC(=CC=C5)Cl)C(=O)CC(C4)(C)C)C

InChI

InChI=1S/C30H29ClN6O2S2/c1-16-8-9-20(10-17(16)2)34-24(39)15-40-29-36-35-28(41-29)37-22-12-30(3,4)13-23(38)26(22)25(21(14-32)27(37)33)18-6-5-7-19(31)11-18/h5-11,25H,12-13,15,33H2,1-4H3,(H,34,39)