2-[[5-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-[[5-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[5-(1,3-dioxoisoindolin-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[5-(1,3-dioxo-2-isoindolyl)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[5-(1,3-dioxoisoindol-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-homoveratryl-2-[(5-phthalimido-1,3,4-thiadiazol-2-yl)thio]acetamide Formula: C22H20N4O5S2 MolecularWeight: 484.548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NN=C(S2)N3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NN=C(S2)N3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C22H20N4O5S2/c1-30-16-8-7-13(11-17(16)31-2)9-10-23-18(27)12-32-22-25-24-21(33-22)26-19(28)14-5-3-4-6-15(14)20(26)29/h3-8,11H,9-10,12H2,1-2H3,(H,23,27)