2-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]acetic acid Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NO2)C3=CSC=C3)CC(=O)O

Isomeric SMILES

C1CN(CCN1CC2=NC(=NO2)C3=CSC=C3)CC(=O)O

InChI

InChI=1S/C13H16N4O3S/c18-12(19)8-17-4-2-16(3-5-17)7-11-14-13(15-20-11)10-1-6-21-9-10/h1,6,9H,2-5,7-8H2,(H,18,19)