(2Z)-3-(3,5-dimethoxyphenyl)-2-(morpholin-4-ylmethylidene)-7-sulfanylidene-heptanenitrile

Systemtic Name: (2Z)-3-(3,5-dimethoxyphenyl)-2-(morpholin-4-ylmethylidene)-7-sulfanylidene-heptanenitrile Openeye Name: (2Z)-3-(3,5-dimethoxyphenyl)-2-(morpholinomethylene)-7-thioxo-heptanenitrile CAS Name: (2Z)-3-(3,5-dimethoxyphenyl)-2-(4-morpholinylmethylidene)-7-sulfanylideneheptanenitrile IUPAC Name: (2Z)-3-(3,5-dimethoxyphenyl)-2-(morpholin-4-ylmethylidene)-7-sulfanylideneheptanenitrile Traditional Name: (Z)-2-[1-(3,5-dimethoxyphenyl)-5-thioxo-pentyl]-3-morpholino-acrylonitrile Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(CCCC=S)C(=CN2CCOCC2)C#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(CCCC=S)/C(=C/N2CCOCC2)/C#N)OC

InChI

InChI=1S/C20H26N2O3S/c1-23-18-11-16(12-19(13-18)24-2)20(5-3-4-10-26)17(14-21)15-22-6-8-25-9-7-22/h10-13,15,20H,3-9H2,1-2H3/b17-15+