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

Systemtic Name: 2-azanyl-4-(4-chlorophenyl)-7,7-dimethyl-5-oxidanylidene-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-1-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-chlorophenyl)-5-keto-7,7-dimethyl-1-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C20H18ClN5OS2 MolecularWeight: 443.97282

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=NNC(=S)S3)N)C#N)C4=CC=C(C=C4)Cl)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=NNC(=S)S3)N)C#N)C4=CC=C(C=C4)Cl)C(=O)C1)C

InChI

InChI=1S/C20H18ClN5OS2/c1-20(2)7-13-16(14(27)8-20)15(10-3-5-11(21)6-4-10)12(9-22)17(23)26(13)18-24-25-19(28)29-18/h3-6,15H,7-8,23H2,1-2H3,(H,25,28)