tert-butyl [3-carbamothioyl-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propyl]phenyl] carbonate

Systemtic Name: tert-butyl [3-carbamothioyl-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propyl]phenyl] carbonate Openeye Name: [4-[2-(tert-butoxycarbonylamino)-3-hydroxy-propyl]-3-carbamothioyl-phenyl] tert-butyl carbonate CAS Name: carbonic acid tert-butyl [3-carbamothioyl-4-[3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]phenyl] ester IUPAC Name: tert-butyl [3-carbamothioyl-4-[3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]phenyl] carbonate Traditional Name: carbonic acid [4-[2-(tert-butoxycarbonylamino)-3-hydroxy-propyl]-3-thiocarbamoyl-phenyl] tert-butyl ester Formula: C20H30N2O6S MolecularWeight: 426.527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(C=C(C=C1)OC(=O)OC(C)(C)C)C(=S)N)CO

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=C(C=C(C=C1)OC(=O)OC(C)(C)C)C(=S)N)CO

InChI

InChI=1S/C20H30N2O6S/c1-19(2,3)27-17(24)22-13(11-23)9-12-7-8-14(10-15(12)16(21)29)26-18(25)28-20(4,5)6/h7-8,10,13,23H,9,11H2,1-6H3,(H2,21,29)(H,22,24)