1-(5-bromanylpyridin-2-yl)-7,7-dimethyl-4-(3-methylthiophen-2-yl)-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-7,7-dimethyl-4-(3-methylthiophen-2-yl)-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 1-(5-bromo-2-pyridyl)-7,7-dimethyl-4-(3-methyl-2-thienyl)-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 1-(5-bromo-2-pyridinyl)-7,7-dimethyl-4-(3-methyl-2-thiophenyl)-5-oxo-2-(1-pyrrolyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 1-(5-bromopyridin-2-yl)-7,7-dimethyl-4-(3-methylthiophen-2-yl)-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 1-(5-bromo-2-pyridyl)-5-keto-7,7-dimethyl-4-(3-methyl-2-thienyl)-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H23BrN4OS MolecularWeight: 519.45602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=NC=C(C=C4)Br)N5C=CC=C5)C#N

Isomeric SMILES

CC1=C(SC=C1)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=NC=C(C=C4)Br)N5C=CC=C5)C#N

InChI

InChI=1S/C26H23BrN4OS/c1-16-8-11-33-24(16)22-18(14-28)25(30-9-4-5-10-30)31(21-7-6-17(27)15-29-21)19-12-26(2,3)13-20(32)23(19)22/h4-11,15,22H,12-13H2,1-3H3