4-(4-bromophenyl)-7,7-dimethyl-2-methylsulfanyl-5-oxidanylidene-3-prop-2-enyl-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 4-(4-bromophenyl)-7,7-dimethyl-2-methylsulfanyl-5-oxidanylidene-3-prop-2-enyl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 3-allyl-4-(4-bromophenyl)-7,7-dimethyl-2-methylsulfanyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 4-(4-bromophenyl)-7,7-dimethyl-2-(methylthio)-5-oxo-3-prop-2-enyl-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 4-(4-bromophenyl)-7,7-dimethyl-2-methylsulfanyl-5-oxo-3-prop-2-enyl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 3-allyl-4-(4-bromophenyl)-5-keto-7,7-dimethyl-2-(methylthio)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C22H23BrN2OS MolecularWeight: 443.39982

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(C(=N2)SC)(CC=C)C#N)C3=CC=C(C=C3)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(C(=N2)SC)(CC=C)C#N)C3=CC=C(C=C3)Br)C(=O)C1)C

InChI

InChI=1S/C22H23BrN2OS/c1-5-10-22(13-24)19(14-6-8-15(23)9-7-14)18-16(25-20(22)27-4)11-21(2,3)12-17(18)26/h5-9,19H,1,10-12H2,2-4H3