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

Systemtic Name: 2-[[5-[2-azanyl-3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[[5-[2-amino-3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[5-[2-amino-3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[[5-[2-amino-3-cyano-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[[5-[2-amino-3-cyano-5-keto-4-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(2,6-dimethylphenyl)acetamide Formula: C31H32N6O3S2 MolecularWeight: 600.75418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H32N6O3S2/c1-17-7-6-8-18(2)27(17)34-24(39)16-41-30-36-35-29(42-30)37-22-13-31(3,4)14-23(38)26(22)25(21(15-32)28(37)33)19-9-11-20(40-5)12-10-19/h6-12,25H,13-14,16,33H2,1-5H3,(H,34,39)