2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-methoxyphenyl)-9-oxidanylidene-indeno[2,1-b]pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(4-methoxyphenyl)-9-oxidanylidene-indeno[2,1-b]pyridine-3-carbonitrile Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-4-(4-methoxyphenyl)-9-oxo-indeno[2,1-b]pyridine-3-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-4-(4-methoxyphenyl)-9-oxo-3-indeno[2,1-b]pyridinecarbonitrile IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-9-oxoindeno[2,1-b]pyridine-3-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-9-keto-4-(4-methoxyphenyl)indeno[2,1-b]pyridine-3-carbonitrile Formula: C28H17BrN2O3S MolecularWeight: 541.41518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NC3=C2C4=CC=CC=C4C3=O)SCC(=O)C5=CC=C(C=C5)Br)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NC3=C2C4=CC=CC=C4C3=O)SCC(=O)C5=CC=C(C=C5)Br)C#N

InChI

InChI=1S/C28H17BrN2O3S/c1-34-19-12-8-17(9-13-19)24-22(14-30)28(35-15-23(32)16-6-10-18(29)11-7-16)31-26-25(24)20-4-2-3-5-21(20)27(26)33/h2-13H,15H2,1H3