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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCNC(=S)NCCCC(C)(C)CC(=O)O)CCO

Isomeric SMILES

CC(C)(CCCNC(=S)NCCCC(C)(C)CC(=O)O)CCO

InChI

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