3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]propanoic acid

Systemtic Name: 3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-propan-2-yl-amino]propanoic acid Openeye Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-isopropyl-amino]propanoic acid CAS Name: 3-[[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-propan-2-ylamino]propanoic acid IUPAC Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-propan-2-ylamino]propanoic acid Traditional Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-isopropyl-amino]propionic acid Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCC(=O)O)C1=NC(=NS1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)N(CCC(=O)O)C1=NC(=NS1)CC2=CC=CC=C2

InChI

InChI=1S/C15H19N3O2S/c1-11(2)18(9-8-14(19)20)15-16-13(17-21-15)10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,19,20)