S-[2-(2,2-dimethylpropanoylamino)phenyl] cyclohexanecarbothioate

Systemtic Name: S-[2-(2,2-dimethylpropanoylamino)phenyl] cyclohexanecarbothioate Openeye Name: S-[2-(2,2-dimethylpropanoylamino)phenyl] cyclohexanecarbothioate CAS Name: cyclohexanecarbothioic acid S-[2-[(2,2-dimethyl-1-oxopropyl)amino]phenyl] ester IUPAC Name: S-[2-(2,2-dimethylpropanoylamino)phenyl] cyclohexanecarbothioate Traditional Name: cyclohexanecarbothioic acid S-[2-(pivaloylamino)phenyl] ester Formula: C18H25NO2S MolecularWeight: 319.4616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC=C1SC(=O)C2CCCCC2

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC=C1SC(=O)C2CCCCC2

InChI

InChI=1S/C18H25NO2S/c1-18(2,3)17(21)19-14-11-7-8-12-15(14)22-16(20)13-9-5-4-6-10-13/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,19,21)