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

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-7,7-dimethyl-5-oxidanylidene-2-pyrrol-1-yl-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 1-(5-bromo-2-pyridyl)-7,7-dimethyl-5-oxo-2-pyrrol-1-yl-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 1-(5-bromo-2-pyridinyl)-7,7-dimethyl-5-oxo-2-(1-pyrrolyl)-4-(3-thiophenyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 1-(5-bromopyridin-2-yl)-7,7-dimethyl-5-oxo-2-pyrrol-1-yl-4-thiophen-3-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 1-(5-bromo-2-pyridyl)-5-keto-7,7-dimethyl-2-pyrrol-1-yl-4-(3-thienyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C25H21BrN4OS MolecularWeight: 505.42944

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=NC=C(C=C3)Br)N4C=CC=C4)C#N)C5=CSC=C5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=NC=C(C=C3)Br)N4C=CC=C4)C#N)C5=CSC=C5)C(=O)C1)C

InChI

InChI=1S/C25H21BrN4OS/c1-25(2)11-19-23(20(31)12-25)22(16-7-10-32-15-16)18(13-27)24(29-8-3-4-9-29)30(19)21-6-5-17(26)14-28-21/h3-10,14-15,22H,11-12H2,1-2H3