2-[[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]amino]propanoic acid

Systemtic Name: 2-[[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 2-[[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]amino]propanoic acid CAS Name: 2-[[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]amino]propanoic acid Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]amino]propionic acid Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCC(=O)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C(=O)O)NCC(=O)NC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C12H13N3O3S/c1-7(11(17)18)13-6-10(16)15-12-14-8-4-2-3-5-9(8)19-12/h2-5,7,13H,6H2,1H3,(H,17,18)(H,14,15,16)