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

Systemtic Name: 2-[[5-[2-azanyl-3-cyano-4-(furan-2-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-cyanophenyl)ethanamide Openeye Name: 2-[[5-[2-amino-3-cyano-4-(2-furyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-cyanophenyl)acetamide CAS Name: 2-[[5-[2-amino-3-cyano-4-(2-furanyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(2-cyanophenyl)acetamide IUPAC Name: 2-[[5-[2-amino-3-cyano-4-(furan-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-cyanophenyl)acetamide Traditional Name: 2-[[5-[2-amino-3-cyano-4-(2-furyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinolin-1-yl]-1,3,4-thiadiazol-2-yl]thio]-N-(2-cyanophenyl)acetamide Formula: C27H23N7O3S2 MolecularWeight: 557.64662

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=CC=CC=C4C#N)N)C#N)C5=CC=CO5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)NC4=CC=CC=C4C#N)N)C#N)C5=CC=CO5)C(=O)C1)C

InChI

InChI=1S/C27H23N7O3S2/c1-27(2)10-18-23(19(35)11-27)22(20-8-5-9-37-20)16(13-29)24(30)34(18)25-32-33-26(39-25)38-14-21(36)31-17-7-4-3-6-15(17)12-28/h3-9,22H,10-11,14,30H2,1-2H3,(H,31,36)