5-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(6-bromo-1,3-benzothiazol-2-yl)amino]-5-oxo-pentanoic acid CAS Name: 5-[(6-bromo-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid IUPAC Name: 5-[(6-bromo-1,3-benzothiazol-2-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(6-bromo-1,3-benzothiazol-2-yl)amino]-5-keto-valeric acid Formula: C12H11BrN2O3S MolecularWeight: 343.19634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CCCC(=O)O

InChI

InChI=1S/C12H11BrN2O3S/c13-7-4-5-8-9(6-7)19-12(14-8)15-10(16)2-1-3-11(17)18/h4-6H,1-3H2,(H,17,18)(H,14,15,16)