7-[(4,4-dimethyl-7-oxidanyl-heptyl)carbamothioylamino]-4,4-dimethyl-heptanoic acid

Systemtic Name: 7-[(4,4-dimethyl-7-oxidanyl-heptyl)carbamothioylamino]-4,4-dimethyl-heptanoic acid Openeye Name: 7-[(7-hydroxy-4,4-dimethyl-heptyl)carbamothioylamino]-4,4-dimethyl-heptanoic acid CAS Name: 7-[[[(7-hydroxy-4,4-dimethylheptyl)amino]-sulfanylidenemethyl]amino]-4,4-dimethylheptanoic acid IUPAC Name: 7-[(7-hydroxy-4,4-dimethylheptyl)carbamothioylamino]-4,4-dimethylheptanoic acid Traditional Name: 7-[(7-hydroxy-4,4-dimethyl-heptyl)thiocarbamoylamino]-4,4-dimethyl-enanthic acid Formula: C19H38N2O3S MolecularWeight: 374.58162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCNC(=S)NCCCC(C)(C)CCC(=O)O)CCCO

Isomeric SMILES

CC(C)(CCCNC(=S)NCCCC(C)(C)CCC(=O)O)CCCO

InChI

InChI=1S/C19H38N2O3S/c1-18(2,11-7-15-22)9-5-13-20-17(25)21-14-6-10-19(3,4)12-8-16(23)24/h22H,5-15H2,1-4H3,(H,23,24)(H2,20,21,25)