5-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 3-(2-thienyl)-5-[(4-veratrylpiperazino)methyl]-1,2,4-oxadiazole Formula: C20H24N4O3S MolecularWeight: 400.49456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4)OC

InChI

InChI=1S/C20H24N4O3S/c1-25-16-6-5-15(12-17(16)26-2)13-23-7-9-24(10-8-23)14-19-21-20(22-27-19)18-4-3-11-28-18/h3-6,11-12H,7-10,13-14H2,1-2H3