5-[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-piperidyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-piperidinyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-(1-homoveratryl-4-piperidyl)-3-(2-thienyl)-1,2,4-oxadiazole Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CCC(CC2)C3=NC(=NO3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CCC(CC2)C3=NC(=NO3)C4=CC=CS4)OC

InChI

InChI=1S/C21H25N3O3S/c1-25-17-6-5-15(14-18(17)26-2)7-10-24-11-8-16(9-12-24)21-22-20(23-27-21)19-4-3-13-28-19/h3-6,13-14,16H,7-12H2,1-2H3