S-[2-[(2-methylpropan-2-yl)oxycarbonyl-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]amino]ethyl] benzenecarbothioate

Systemtic Name: S-[2-[(2-methylpropan-2-yl)oxycarbonyl-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]amino]ethyl] benzenecarbothioate Openeye Name: S-[2-[tert-butoxycarbonyl-[(tert-butoxycarbonylamino)methyl]amino]ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]amino]ethyl] ester IUPAC Name: S-[2-[(2-methylpropan-2-yl)oxycarbonyl-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]amino]ethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[tert-butoxycarbonyl-[(tert-butoxycarbonylamino)methyl]amino]ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCN(CCSC(=O)C1=CC=CC=C1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NCN(CCSC(=O)C1=CC=CC=C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H30N2O5S/c1-19(2,3)26-17(24)21-14-22(18(25)27-20(4,5)6)12-13-28-16(23)15-10-8-7-9-11-15/h7-11H,12-14H2,1-6H3,(H,21,24)