tert-butyl N-[(2S)-1-cyclohexyl-3-(2-methylphenyl)sulfanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-cyclohexyl-3-(2-methylphenyl)sulfanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(cyclohexylmethyl)-2-(o-tolylsulfanyl)ethyl]carbamate CAS Name: N-[(2S)-1-cyclohexyl-3-[(2-methylphenyl)thio]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-cyclohexyl-3-(2-methylphenyl)sulfanylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-(cyclohexylmethyl)-2-(o-tolylthio)ethyl]carbamic acid tert-butyl ester Formula: C21H33NO2S MolecularWeight: 363.55722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(CC2CCCCC2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1SC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H33NO2S/c1-16-10-8-9-13-19(16)25-15-18(14-17-11-6-5-7-12-17)22-20(23)24-21(2,3)4/h8-10,13,17-18H,5-7,11-12,14-15H2,1-4H3,(H,22,23)/t18-/m0/s1