methyl 3-tert-butylperoxy-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate

Systemtic Name: methyl 3-tert-butylperoxy-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate Openeye Name: methyl 3-tert-butylperoxy-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate CAS Name: 3-tert-butyldioxy-2-[[oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-tert-butylperoxy-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate Traditional Name: 3-tert-butylperoxy-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propionic acid methyl ester Formula: C11H18N4O5S2 MolecularWeight: 350.41442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OOCC(C(=O)OC)NC(=O)NC1=NNC(=S)S1

Isomeric SMILES

CC(C)(C)OOCC(C(=O)OC)NC(=O)NC1=NNC(=S)S1

InChI

InChI=1S/C11H18N4O5S2/c1-11(2,3)20-19-5-6(7(16)18-4)12-8(17)13-9-14-15-10(21)22-9/h6H,5H2,1-4H3,(H,15,21)(H2,12,13,14,17)