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

Systemtic Name: 4-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-9-oxidanylidene-indeno[2,1-b]pyridine-3-carbonitrile Openeye Name: 4-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-9-oxo-indeno[2,1-b]pyridine-3-carbonitrile CAS Name: 4-(4-methoxyphenyl)-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-9-oxo-3-indeno[2,1-b]pyridinecarbonitrile IUPAC Name: 4-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-9-oxoindeno[2,1-b]pyridine-3-carbonitrile Traditional Name: 9-keto-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-(4-methoxyphenyl)indeno[2,1-b]pyridine-3-carbonitrile Formula: C29H20N2O4S MolecularWeight: 492.5451

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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)OC)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)OC)C#N

InChI

InChI=1S/C29H20N2O4S/c1-34-19-11-7-17(8-12-19)24(32)16-36-29-23(15-30)25(18-9-13-20(35-2)14-10-18)26-21-5-3-4-6-22(21)28(33)27(26)31-29/h3-14H,16H2,1-2H3