2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]-1-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]-1-(4-veratrylpiperazino)ethanone Formula: C24H26N4O6S MolecularWeight: 498.55144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CSC3=NN=C(O3)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CSC3=NN=C(O3)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C24H26N4O6S/c1-30-18-5-3-16(11-20(18)31-2)13-27-7-9-28(10-8-27)22(29)14-35-24-26-25-23(34-24)17-4-6-19-21(12-17)33-15-32-19/h3-6,11-12H,7-10,13-15H2,1-2H3