4-[1,3-benzothiazol-2-ylcarbamoyl(methyl)amino]butanoic acid

Systemtic Name: 4-[1,3-benzothiazol-2-ylcarbamoyl(methyl)amino]butanoic acid Openeye Name: 4-[1,3-benzothiazol-2-ylcarbamoyl(methyl)amino]butanoic acid CAS Name: 4-[[(1,3-benzothiazol-2-ylamino)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[1,3-benzothiazol-2-ylcarbamoyl(methyl)amino]butanoic acid Traditional Name: 4-[1,3-benzothiazol-2-ylcarbamoyl(methyl)amino]butyric acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CN(CCCC(=O)O)C(=O)NC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H15N3O3S/c1-16(8-4-7-11(17)18)13(19)15-12-14-9-5-2-3-6-10(9)20-12/h2-3,5-6H,4,7-8H2,1H3,(H,17,18)(H,14,15,19)