6-[(5,5-dimethyl-6-oxidanyl-hexyl)carbamothioylamino]-2,2-dimethyl-hexanoic acid

Systemtic Name: 6-[(5,5-dimethyl-6-oxidanyl-hexyl)carbamothioylamino]-2,2-dimethyl-hexanoic acid Openeye Name: 6-[(6-hydroxy-5,5-dimethyl-hexyl)carbamothioylamino]-2,2-dimethyl-hexanoic acid CAS Name: 6-[[[(6-hydroxy-5,5-dimethylhexyl)amino]-sulfanylidenemethyl]amino]-2,2-dimethylhexanoic acid IUPAC Name: 6-[(6-hydroxy-5,5-dimethylhexyl)carbamothioylamino]-2,2-dimethylhexanoic acid Traditional Name: 6-[(6-hydroxy-5,5-dimethyl-hexyl)thiocarbamoylamino]-2,2-dimethyl-hexanoic acid Formula: C17H34N2O3S MolecularWeight: 346.52846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCNC(=S)NCCCCC(C)(C)C(=O)O)CO

Isomeric SMILES

CC(C)(CCCCNC(=S)NCCCCC(C)(C)C(=O)O)CO

InChI

InChI=1S/C17H34N2O3S/c1-16(2,13-20)9-5-7-11-18-15(23)19-12-8-6-10-17(3,4)14(21)22/h20H,5-13H2,1-4H3,(H,21,22)(H2,18,19,23)