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

Systemtic Name: 6-azanylidene-1-ethyl-8-methyl-3-(5-methylthiophen-2-yl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 1-ethyl-6-imino-8-methyl-3-(5-methyl-2-thienyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 1-ethyl-6-imino-8-methyl-3-(5-methyl-2-thiophenyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 1-ethyl-6-imino-8-methyl-3-(5-methylthiophen-2-yl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 1-ethyl-6-imino-8-methyl-3-(5-methyl-2-thienyl)-2,7-dioxabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CCC12C(C(C(=N)O1)(C(C(O2)C3=CC=C(S3)C)(C#N)C#N)C#N)C

Isomeric SMILES

CCC12C(C(C(=N)O1)(C(C(O2)C3=CC=C(S3)C)(C#N)C#N)C#N)C

InChI

InChI=1S/C17H16N4O2S/c1-4-17-11(3)16(9-20,14(21)23-17)15(7-18,8-19)13(22-17)12-6-5-10(2)24-12/h5-6,11,13,21H,4H2,1-3H3