[2-[2-[bis(azanyl)methylideneamino]-4-tert-butyl-1,3-thiazol-5-yl]-2-oxidanylidene-1-piperidin-3-yl-ethyl] ethaneperoxoate

Systemtic Name: [2-[2-[bis(azanyl)methylideneamino]-4-tert-butyl-1,3-thiazol-5-yl]-2-oxidanylidene-1-piperidin-3-yl-ethyl] ethaneperoxoate Openeye Name: [2-(4-tert-butyl-2-guanidino-thiazol-5-yl)-2-oxo-1-(3-piperidyl)ethyl] peroxyacetate CAS Name: ethaneperoxoic acid [2-[4-tert-butyl-2-(diaminomethylideneamino)-5-thiazolyl]-2-oxo-1-(3-piperidinyl)ethyl] ester IUPAC Name: [2-[4-tert-butyl-2-(diaminomethylideneamino)-1,3-thiazol-5-yl]-2-oxo-1-piperidin-3-ylethyl] ethaneperoxoate Traditional Name: peracetic acid [2-(4-tert-butyl-2-guanidino-thiazol-5-yl)-2-keto-1-(3-piperidyl)ethyl] ester Formula: C17H27N5O4S MolecularWeight: 397.49238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OOC(C1CCCNC1)C(=O)C2=C(N=C(S2)N=C(N)N)C(C)(C)C

Isomeric SMILES

CC(=O)OOC(C1CCCNC1)C(=O)C2=C(N=C(S2)N=C(N)N)C(C)(C)C

InChI

InChI=1S/C17H27N5O4S/c1-9(23)25-26-12(10-6-5-7-20-8-10)11(24)13-14(17(2,3)4)21-16(27-13)22-15(18)19/h10,12,20H,5-8H2,1-4H3,(H4,18,19,21,22)