tert-butyl 2-[[2-cyclohexylethyl(2-ethanoylsulfanylethyl)carbamoyl]amino]propanoate

Systemtic Name: tert-butyl 2-[[2-cyclohexylethyl(2-ethanoylsulfanylethyl)carbamoyl]amino]propanoate Openeye Name: tert-butyl 2-[[2-acetylsulfanylethyl(2-cyclohexylethyl)carbamoyl]amino]propanoate CAS Name: 2-[[[2-(acetylthio)ethyl-(2-cyclohexylethyl)amino]-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-acetylsulfanylethyl(2-cyclohexylethyl)carbamoyl]amino]propanoate Traditional Name: 2-[[2-(acetylthio)ethyl-(2-cyclohexylethyl)carbamoyl]amino]propionic acid tert-butyl ester Formula: C20H36N2O4S MolecularWeight: 400.57584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)NC(=O)N(CCC1CCCCC1)CCSC(=O)C

Isomeric SMILES

CC(C(=O)OC(C)(C)C)NC(=O)N(CCC1CCCCC1)CCSC(=O)C

InChI

InChI=1S/C20H36N2O4S/c1-15(18(24)26-20(3,4)5)21-19(25)22(13-14-27-16(2)23)12-11-17-9-7-6-8-10-17/h15,17H,6-14H2,1-5H3,(H,21,25)