S-[2,3-bis[(2-methylpropan-2-yl)oxycarbonylamino]propyl] benzenecarbothioate

Systemtic Name: S-[2,3-bis[(2-methylpropan-2-yl)oxycarbonylamino]propyl] benzenecarbothioate Openeye Name: S-[2,3-bis(tert-butoxycarbonylamino)propyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2,3-bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl] ester IUPAC Name: S-[2,3-bis[(2-methylpropan-2-yl)oxycarbonylamino]propyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2,3-bis(tert-butoxycarbonylamino)propyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(CSC(=O)C1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NCC(CSC(=O)C1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

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