(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-azanyl-3-tert-butylperoxy-butanoate

Systemtic Name: (2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-azanyl-3-tert-butylperoxy-butanoate Openeye Name: (2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-amino-3-tert-butylperoxy-butanoate CAS Name: 2-amino-3-tert-butyldioxybutanoic acid [oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl] ester IUPAC Name: (2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-amino-3-tert-butylperoxybutanoate Traditional Name: 2-amino-3-tert-butylperoxy-butyric acid (2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl ester Formula: C11H18N4O5S2 MolecularWeight: 350.41442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC(=O)NC1=NNC(=S)S1)N)OOC(C)(C)C

Isomeric SMILES

CC(C(C(=O)OC(=O)NC1=NNC(=S)S1)N)OOC(C)(C)C

InChI

InChI=1S/C11H18N4O5S2/c1-5(19-20-11(2,3)4)6(12)7(16)18-9(17)13-8-14-15-10(21)22-8/h5-6H,12H2,1-4H3,(H,15,21)(H,13,14,17)