4-[2-azanyl-1-(2-azanyl-1,3-thiazol-4-yl)-3-methyl-1-oxidanyl-butyl]benzoic acid

Systemtic Name: 4-[2-azanyl-1-(2-azanyl-1,3-thiazol-4-yl)-3-methyl-1-oxidanyl-butyl]benzoic acid Openeye Name: 4-[2-amino-1-(2-aminothiazol-4-yl)-1-hydroxy-3-methyl-butyl]benzoic acid CAS Name: 4-[2-amino-1-(2-amino-4-thiazolyl)-1-hydroxy-3-methylbutyl]benzoic acid IUPAC Name: 4-[2-amino-1-(2-amino-1,3-thiazol-4-yl)-1-hydroxy-3-methylbutyl]benzoic acid Traditional Name: 4-[2-amino-1-(2-aminothiazol-4-yl)-1-hydroxy-3-methyl-butyl]benzoic acid Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C1=CC=C(C=C1)C(=O)O)(C2=CSC(=N2)N)O)N

Isomeric SMILES

CC(C)C(C(C1=CC=C(C=C1)C(=O)O)(C2=CSC(=N2)N)O)N

InChI

InChI=1S/C15H19N3O3S/c1-8(2)12(16)15(21,11-7-22-14(17)18-11)10-5-3-9(4-6-10)13(19)20/h3-8,12,21H,16H2,1-2H3,(H2,17,18)(H,19,20)