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

Systemtic Name: 2-azanyl-4-(2,5-dimethoxyphenyl)-1-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(2,5-dimethoxyphenyl)-1-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-(2,5-dimethoxyphenyl)-1-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2,5-dimethoxyphenyl)-1-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-(2,5-dimethoxyphenyl)-1-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C24H27N5O3S2 MolecularWeight: 497.63288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=C(C=CC(=C4)OC)OC)C(=O)CC(C3)(C)C

Isomeric SMILES

CCSC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=C(C=CC(=C4)OC)OC)C(=O)CC(C3)(C)C

InChI

InChI=1S/C24H27N5O3S2/c1-6-33-23-28-27-22(34-23)29-16-10-24(2,3)11-17(30)20(16)19(15(12-25)21(29)26)14-9-13(31-4)7-8-18(14)32-5/h7-9,19H,6,10-11,26H2,1-5H3