1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[[5-(2-thienyl)isoxazol-3-yl]methoxy]ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-[(5-thiophen-2-yl-3-isoxazolyl)methoxy]ethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]ethanone Traditional Name: 1-(4-piperonylpiperazino)-2-[[5-(2-thienyl)isoxazol-3-yl]methoxy]ethanone Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)COCC4=NOC(=C4)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)COCC4=NOC(=C4)C5=CC=CS5

InChI

InChI=1S/C22H23N3O5S/c26-22(14-27-13-17-11-20(30-23-17)21-2-1-9-31-21)25-7-5-24(6-8-25)12-16-3-4-18-19(10-16)29-15-28-18/h1-4,9-11H,5-8,12-15H2