5-[5-(cyanoamino)-4,4-dimethyl-5-oxidanylidene-pentyl]sulfanyl-2,2-dimethyl-pentanoic acid

Systemtic Name: 5-[5-(cyanoamino)-4,4-dimethyl-5-oxidanylidene-pentyl]sulfanyl-2,2-dimethyl-pentanoic acid Openeye Name: 5-[5-(cyanoamino)-4,4-dimethyl-5-oxo-pentyl]sulfanyl-2,2-dimethyl-pentanoic acid CAS Name: 5-[[5-(cyanoamino)-4,4-dimethyl-5-oxopentyl]thio]-2,2-dimethylpentanoic acid IUPAC Name: 5-[5-(cyanoamino)-4,4-dimethyl-5-oxopentyl]sulfanyl-2,2-dimethylpentanoic acid Traditional Name: 5-[[5-(cyanoamino)-5-keto-4,4-dimethyl-pentyl]thio]-2,2-dimethyl-valeric acid Formula: C15H26N2O3S MolecularWeight: 314.44354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCSCCCC(C)(C)C(=O)O)C(=O)NC#N

Isomeric SMILES

CC(C)(CCCSCCCC(C)(C)C(=O)O)C(=O)NC#N

InChI

InChI=1S/C15H26N2O3S/c1-14(2,12(18)17-11-16)7-5-9-21-10-6-8-15(3,4)13(19)20/h5-10H2,1-4H3,(H,17,18)(H,19,20)