2-azanyl-7,7-dimethyl-4-(4-methylphenyl)-1-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-7,7-dimethyl-4-(4-methylphenyl)-1-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-7,7-dimethyl-1-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-5-oxo-4-(p-tolyl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-7,7-dimethyl-4-(4-methylphenyl)-1-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-7,7-dimethyl-4-(4-methylphenyl)-1-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-7,7-dimethyl-1-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-4-(p-tolyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C22H23N5OS2 MolecularWeight: 437.58092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=NN=C(S4)SC)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=NN=C(S4)SC)N)C#N

InChI

InChI=1S/C22H23N5OS2/c1-12-5-7-13(8-6-12)17-14(11-23)19(24)27(20-25-26-21(29-4)30-20)15-9-22(2,3)10-16(28)18(15)17/h5-8,17H,9-10,24H2,1-4H3