S-[2-[[1-(2-ethylbutyl)cyclohexyl]carbonylamino]phenyl] hexanethioate

Systemtic Name: S-[2-[[1-(2-ethylbutyl)cyclohexyl]carbonylamino]phenyl] hexanethioate Openeye Name: S-[2-[[1-(2-ethylbutyl)cyclohexanecarbonyl]amino]phenyl] hexanethioate CAS Name: hexanethioic acid S-[2-[[[1-(2-ethylbutyl)cyclohexyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[[1-(2-ethylbutyl)cyclohexanecarbonyl]amino]phenyl] hexanethioate Traditional Name: hexanethioic acid S-[2-[[1-(2-ethylbutyl)cyclohexanecarbonyl]amino]phenyl] ester Formula: C25H39NO2S MolecularWeight: 417.64766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)SC1=CC=CC=C1NC(=O)C2(CCCCC2)CC(CC)CC

Isomeric SMILES

CCCCCC(=O)SC1=CC=CC=C1NC(=O)C2(CCCCC2)CC(CC)CC

InChI

InChI=1S/C25H39NO2S/c1-4-7-9-16-23(27)29-22-15-11-10-14-21(22)26-24(28)25(17-12-8-13-18-25)19-20(5-2)6-3/h10-11,14-15,20H,4-9,12-13,16-19H2,1-3H3,(H,26,28)