7-[2-(tert-butyldiazenyl)propan-2-ylcarbamothioylamino]heptanoic acid

Systemtic Name: 7-[2-(tert-butyldiazenyl)propan-2-ylcarbamothioylamino]heptanoic acid Openeye Name: 7-[(1-tert-butylazo-1-methyl-ethyl)carbamothioylamino]heptanoic acid CAS Name: 7-[[(2-tert-butylazopropan-2-ylamino)-sulfanylidenemethyl]amino]heptanoic acid IUPAC Name: 7-[2-(tert-butyldiazenyl)propan-2-ylcarbamothioylamino]heptanoic acid Traditional Name: 7-[(1-tert-butylazo-1-methyl-ethyl)thiocarbamoylamino]enanthic acid Formula: C15H30N4O2S MolecularWeight: 330.4893

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=NC(C)(C)NC(=S)NCCCCCCC(=O)O

Isomeric SMILES

CC(C)(C)N=NC(C)(C)NC(=S)NCCCCCCC(=O)O

InChI

InChI=1S/C15H30N4O2S/c1-14(2,3)18-19-15(4,5)17-13(22)16-11-9-7-6-8-10-12(20)21/h6-11H2,1-5H3,(H,20,21)(H2,16,17,22)