2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-5-phenacyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-5-phenacyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-4,6-dimethyl-5-phenacyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-4,6-dimethyl-5-phenacyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-4,6-dimethyl-5-phenacylpyridine-3-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-4,6-dimethyl-5-phenacyl-nicotinonitrile Formula: C24H19BrN2O2S MolecularWeight: 479.38886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1CC(=O)C2=CC=CC=C2)C)SCC(=O)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1CC(=O)C2=CC=CC=C2)C)SCC(=O)C3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C24H19BrN2O2S/c1-15-20(12-22(28)17-6-4-3-5-7-17)16(2)27-24(21(15)13-26)30-14-23(29)18-8-10-19(25)11-9-18/h3-11H,12,14H2,1-2H3