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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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