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

Systemtic Name: 2-azanyl-1-(3-bromophenyl)-7,7-dimethyl-5-oxidanylidene-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(3-bromophenyl)-7,7-dimethyl-5-oxo-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(3-bromophenyl)-7,7-dimethyl-5-oxo-4-(3-thiophenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(3-bromophenyl)-7,7-dimethyl-5-oxo-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(3-bromophenyl)-5-keto-7,7-dimethyl-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C22H20BrN3OS MolecularWeight: 454.3827

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)Br)N)C#N)C4=CSC=C4)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=CC(=CC=C3)Br)N)C#N)C4=CSC=C4)C(=O)C1)C

InChI

InChI=1S/C22H20BrN3OS/c1-22(2)9-17-20(18(27)10-22)19(13-6-7-28-12-13)16(11-24)21(25)26(17)15-5-3-4-14(23)8-15/h3-8,12,19H,9-10,25H2,1-2H3