6-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-methylsulfanyl-5,6-dihydro-4H-phenalene-1-carbonitrile

Systemtic Name: 6-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-methylsulfanyl-5,6-dihydro-4H-phenalene-1-carbonitrile Openeye Name: 6-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-methylsulfanyl-5,6-dihydro-4H-phenalene-1-carbonitrile CAS Name: 6-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-(methylthio)-5,6-dihydro-4H-phenalene-1-carbonitrile IUPAC Name: 6-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-methylsulfanyl-5,6-dihydro-4H-phenalene-1-carbonitrile Traditional Name: 6-(3,4-dimethoxyphenyl)-7,8-dimethoxy-2-(methylthio)-5,6-dihydro-4H-phenalene-1-carbonitrile Formula: C25H25NO4S MolecularWeight: 435.5353

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCC3=CC(=C(C4=CC(=C(C2=C34)OC)OC)C#N)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCC3=CC(=C(C4=CC(=C(C2=C34)OC)OC)C#N)SC)OC

InChI

InChI=1S/C25H25NO4S/c1-27-19-9-7-14(10-20(19)28-2)16-8-6-15-11-22(31-5)18(13-26)17-12-21(29-3)25(30-4)24(16)23(15)17/h7,9-12,16H,6,8H2,1-5H3