N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(1-pyrrolyl)phenyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-homoveratryl-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole-5-carboxamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=NC(=NO2)C3=CC=C(C=C3)N4C=CC=C4)OC

InChI

InChI=1S/C23H22N4O4/c1-29-19-10-5-16(15-20(19)30-2)11-12-24-22(28)23-25-21(26-31-23)17-6-8-18(9-7-17)27-13-3-4-14-27/h3-10,13-15H,11-12H2,1-2H3,(H,24,28)