5-oxidanylidene-2-phenacylsulfanyl-4-(3,4,5-trimethoxyphenyl)indeno[1,2-b]pyridine-3-carbonitrile

Systemtic Name: 5-oxidanylidene-2-phenacylsulfanyl-4-(3,4,5-trimethoxyphenyl)indeno[1,2-b]pyridine-3-carbonitrile Openeye Name: 5-oxo-2-phenacylsulfanyl-4-(3,4,5-trimethoxyphenyl)indeno[1,2-b]pyridine-3-carbonitrile CAS Name: 5-oxo-2-(phenacylthio)-4-(3,4,5-trimethoxyphenyl)-3-indeno[1,2-b]pyridinecarbonitrile IUPAC Name: 5-oxo-2-phenacylsulfanyl-4-(3,4,5-trimethoxyphenyl)indeno[1,2-b]pyridine-3-carbonitrile Traditional Name: 5-keto-2-(phenacylthio)-4-(3,4,5-trimethoxyphenyl)indeno[1,2-b]pyridine-3-carbonitrile Formula: C30H22N2O5S MolecularWeight: 522.57108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC3=C2C(=O)C4=CC=CC=C43)SCC(=O)C5=CC=CC=C5)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC3=C2C(=O)C4=CC=CC=C43)SCC(=O)C5=CC=CC=C5)C#N

InChI

InChI=1S/C30H22N2O5S/c1-35-23-13-18(14-24(36-2)29(23)37-3)25-21(15-31)30(38-16-22(33)17-9-5-4-6-10-17)32-27-19-11-7-8-12-20(19)28(34)26(25)27/h4-14H,16H2,1-3H3