tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]carbamoylamino]-N-[2-(pyridin-2-yldisulfanyl)ethylcarbamoyl]carbamate

Systemtic Name: tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]carbamoylamino]-N-[2-(pyridin-2-yldisulfanyl)ethylcarbamoyl]carbamate Openeye Name: tert-butyl N-[(tert-butoxycarbonylamino)carbamoylamino]-N-[2-(2-pyridyldisulfanyl)ethylcarbamoyl]carbamate CAS Name: N-[[[[(2-methylpropan-2-yl)oxy-oxomethyl]hydrazo]-oxomethyl]amino]-N-[oxo-[2-(2-pyridinyldisulfanyl)ethylamino]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[(2-methylpropan-2-yl)oxycarbonylamino]carbamoylamino]-N-[2-(pyridin-2-yldisulfanyl)ethylcarbamoyl]carbamate Traditional Name: N-[(tert-butoxycarbonylamino)carbamoylamino]-N-[2-(2-pyridyldisulfanyl)ethylcarbamoyl]carbamic acid tert-butyl ester Formula: C19H30N6O6S2 MolecularWeight: 502.6081

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=O)NN(C(=O)NCCSSC1=CC=CC=N1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=O)NN(C(=O)NCCSSC1=CC=CC=N1)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H30N6O6S2/c1-18(2,3)30-16(28)23-22-14(26)24-25(17(29)31-19(4,5)6)15(27)21-11-12-32-33-13-9-7-8-10-20-13/h7-10H,11-12H2,1-6H3,(H,21,27)(H,23,28)(H2,22,24,26)