6-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl]sulfanyl-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl]sulfanyl-6-oxidanylidene-hexanoic acid Openeye Name: 6-[2-[(1-isopentylcyclohexanecarbonyl)amino]phenyl]sulfanyl-6-oxo-hexanoic acid CAS Name: 6-[[2-[[[1-(3-methylbutyl)cyclohexyl]-oxomethyl]amino]phenyl]thio]-6-oxohexanoic acid IUPAC Name: 6-[2-[[1-(3-methylbutyl)cyclohexanecarbonyl]amino]phenyl]sulfanyl-6-oxohexanoic acid Traditional Name: 6-[[2-[(1-isoamylcyclohexanecarbonyl)amino]phenyl]thio]-6-keto-hexanoic acid Formula: C24H35NO4S MolecularWeight: 433.604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)CCCCC(=O)O

Isomeric SMILES

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)CCCCC(=O)O

InChI

InChI=1S/C24H35NO4S/c1-18(2)14-17-24(15-8-3-9-16-24)23(29)25-19-10-4-5-11-20(19)30-22(28)13-7-6-12-21(26)27/h4-5,10-11,18H,3,6-9,12-17H2,1-2H3,(H,25,29)(H,26,27)