S-[4-[[1-(2-ethylbutyl)cyclohexyl]carbonylamino]phenyl] 2-methylpropanethioate

Systemtic Name: S-[4-[[1-(2-ethylbutyl)cyclohexyl]carbonylamino]phenyl] 2-methylpropanethioate Openeye Name: S-[4-[[1-(2-ethylbutyl)cyclohexanecarbonyl]amino]phenyl] 2-methylpropanethioate CAS Name: 2-methylpropanethioic acid S-[4-[[[1-(2-ethylbutyl)cyclohexyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[4-[[1-(2-ethylbutyl)cyclohexanecarbonyl]amino]phenyl] 2-methylpropanethioate Traditional Name: 2-methylpropanethioic acid S-[4-[[1-(2-ethylbutyl)cyclohexanecarbonyl]amino]phenyl] ester Formula: C23H35NO2S MolecularWeight: 389.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC1(CCCCC1)C(=O)NC2=CC=C(C=C2)SC(=O)C(C)C

Isomeric SMILES

CCC(CC)CC1(CCCCC1)C(=O)NC2=CC=C(C=C2)SC(=O)C(C)C

InChI

InChI=1S/C23H35NO2S/c1-5-18(6-2)16-23(14-8-7-9-15-23)22(26)24-19-10-12-20(13-11-19)27-21(25)17(3)4/h10-13,17-18H,5-9,14-16H2,1-4H3,(H,24,26)