7-azanylidene-8-methyl-3-(4-methylsulfanylphenyl)-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile

Systemtic Name: 7-azanylidene-8-methyl-3-(4-methylsulfanylphenyl)-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 7-imino-8-methyl-3-(4-methylsulfanylphenyl)-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 7-imino-8-methyl-3-[4-(methylthio)phenyl]-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 7-imino-8-methyl-3-(4-methylsulfanylphenyl)-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 7-imino-8-methyl-3-[4-(methylthio)phenyl]-5-phenyl-4,6-dioxabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C23H18N4O2S MolecularWeight: 414.47962

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)C3=CC=C(C=C3)SC)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1C2(C(=N)OC1(OC(C2(C#N)C#N)C3=CC=C(C=C3)SC)C4=CC=CC=C4)C#N

InChI

InChI=1S/C23H18N4O2S/c1-15-22(14-26)20(27)29-23(15,17-6-4-3-5-7-17)28-19(21(22,12-24)13-25)16-8-10-18(30-2)11-9-16/h3-11,15,19,27H,1-2H3