butyl [6-(butoxysulfinylmethyl)-1,4-dihydro-1,2,4,5-tetrazin-3-yl]methanesulfinate

Systemtic Name: butyl [6-(butoxysulfinylmethyl)-1,4-dihydro-1,2,4,5-tetrazin-3-yl]methanesulfinate Openeye Name: butyl [6-(butoxysulfinylmethyl)-1,4-dihydro-1,2,4,5-tetrazin-3-yl]methanesulfinate CAS Name: [6-(butoxysulfinylmethyl)-1,4-dihydro-1,2,4,5-tetrazin-3-yl]methanesulfinic acid butyl ester IUPAC Name: butyl [6-(butoxysulfinylmethyl)-1,4-dihydro-1,2,4,5-tetrazin-3-yl]methanesulfinate Traditional Name: [6-(butoxysulfinylmethyl)-1,4-dihydro-1,2,4,5-tetrazin-3-yl]methanesulfinic acid butyl ester Formula: C12H24N4O4S2 MolecularWeight: 352.47336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOS(=O)CC1=NNC(=NN1)CS(=O)OCCCC

Isomeric SMILES

CCCCOS(=O)CC1=NNC(=NN1)CS(=O)OCCCC

InChI

InChI=1S/C12H24N4O4S2/c1-3-5-7-19-21(17)9-11-13-15-12(16-14-11)10-22(18)20-8-6-4-2/h3-10H2,1-2H3,(H,13,14)(H,15,16)