methyl (1E)-2-azanyl-N-(methylcarbamoyloxysulfanyl)-2-oxidanylidene-ethanimidate; (propan-2-ylamino)phosphonic acid

Systemtic Name: methyl (1E)-2-azanyl-N-(methylcarbamoyloxysulfanyl)-2-oxidanylidene-ethanimidate; (propan-2-ylamino)phosphonic acid Openeye Name: (isopropylamino)phosphonic acid; methyl (1E)-2-amino-N-(methylcarbamoyloxysulfanyl)-2-oxo-ethanimidate CAS Name: (1E)-2-amino-N-(methylcarbamoyloxythio)-2-oxoethanimidic acid methyl ester; (propan-2-ylamino)phosphonic acid IUPAC Name: methyl (1E)-2-amino-N-(methylcarbamoyloxysulfanyl)-2-oxoethanimidate; (propan-2-ylamino)phosphonic acid Traditional Name: (1E)-2-amino-2-keto-N-(methylcarbamoyloxythio)acetimidic acid methyl ester; (isopropylamino)phosphonic acid Formula: C8H19N4O7PS MolecularWeight: 346.297821

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NP(=O)(O)O.CNC(=O)OSN=C(C(=O)N)OC

Isomeric SMILES

CC(C)NP(=O)(O)O.CNC(=O)OS/N=C(\C(=O)N)/OC

InChI

InChI=1S/C5H9N3O4S.C3H10NO3P/c1-7-5(10)12-13-8-4(11-2)3(6)9;1-3(2)4-8(5,6)7/h1-2H3,(H2,6,9)(H,7,10);3H,1-2H3,(H3,4,5,6,7)/b8-4+;