N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-6-yl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-6-yl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-6-yl)-1,2,4-oxadiazole-5-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-6-yl)-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-indol-6-yl)-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-homoveratryl-3-(1H-indol-6-yl)-1,2,4-oxadiazole-5-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=NC(=NO2)C3=CC4=C(C=C3)C=CN4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=NC(=NO2)C3=CC4=C(C=C3)C=CN4)OC

InChI

InChI=1S/C21H20N4O4/c1-27-17-6-3-13(11-18(17)28-2)7-9-23-20(26)21-24-19(25-29-21)15-5-4-14-8-10-22-16(14)12-15/h3-6,8,10-12,22H,7,9H2,1-2H3,(H,23,26)