2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(2-methoxyphenyl)-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(2-methoxyphenyl)-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-4-(2-methoxyphenyl)-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-4-(2-methoxyphenyl)-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-4-(2-methoxyphenyl)-6-phenylpyridine-3-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-4-(2-methoxyphenyl)-6-phenyl-nicotinonitrile Formula: C27H19BrN2O2S MolecularWeight: 515.42096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C27H19BrN2O2S/c1-32-26-10-6-5-9-21(26)22-15-24(18-7-3-2-4-8-18)30-27(23(22)16-29)33-17-25(31)19-11-13-20(28)14-12-19/h2-15H,17H2,1H3