N-[[5-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[5-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[[5-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide CAS Name: N-[[5-[[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[5-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide Traditional Name: N-[[5-[[2-(homoveratrylamino)-2-keto-ethyl]thio]-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NN=C(O2)CNC(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NN=C(O2)CNC(=O)C3=CC=CS3)OC

InChI

InChI=1S/C20H22N4O5S2/c1-27-14-6-5-13(10-15(14)28-2)7-8-21-17(25)12-31-20-24-23-18(29-20)11-22-19(26)16-4-3-9-30-16/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,21,25)(H,22,26)