6-[(3,3-dimethyl-6-oxidanyl-hexyl)carbamothioylamino]-4,4-dimethyl-hexanoic acid

Systemtic Name: 6-[(3,3-dimethyl-6-oxidanyl-hexyl)carbamothioylamino]-4,4-dimethyl-hexanoic acid Openeye Name: 6-[(6-hydroxy-3,3-dimethyl-hexyl)carbamothioylamino]-4,4-dimethyl-hexanoic acid CAS Name: 6-[[[(6-hydroxy-3,3-dimethylhexyl)amino]-sulfanylidenemethyl]amino]-4,4-dimethylhexanoic acid IUPAC Name: 6-[(6-hydroxy-3,3-dimethylhexyl)carbamothioylamino]-4,4-dimethylhexanoic acid Traditional Name: 6-[(6-hydroxy-3,3-dimethyl-hexyl)thiocarbamoylamino]-4,4-dimethyl-hexanoic acid Formula: C17H34N2O3S MolecularWeight: 346.52846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCO)CCNC(=S)NCCC(C)(C)CCC(=O)O

Isomeric SMILES

CC(C)(CCCO)CCNC(=S)NCCC(C)(C)CCC(=O)O

InChI

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