3-[4-(1,3-thiazol-4-ylmethyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(1,3-thiazol-4-ylmethyl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(thiazol-4-ylmethyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-(4-thiazolylmethyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(1,3-thiazol-4-ylmethyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(thiazol-4-ylmethyl)piperazino]propionic acid Formula: C11H17N3O2S MolecularWeight: 255.33658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)CC2=CSC=N2

Isomeric SMILES

C1CN(CCN1CCC(=O)O)CC2=CSC=N2

InChI

InChI=1S/C11H17N3O2S/c15-11(16)1-2-13-3-5-14(6-4-13)7-10-8-17-9-12-10/h8-9H,1-7H2,(H,15,16)