calcium N-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfamate

Systemtic Name: calcium N-[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfamate Openeye Name: calcium N-(4,6-diamino-1,3,5-triazin-2-yl)sulfamate CAS Name: calcium N-(4,6-diamino-1,3,5-triazin-2-yl)sulfamate IUPAC Name: calcium N-(4,6-diamino-1,3,5-triazin-2-yl)sulfamate Traditional Name: calcium N-(4,6-diamino-s-triazin-2-yl)sulfamate Formula: C6H10CaN12O6S2 MolecularWeight: 450.4284

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Descriptors Computed from Structure

Canonical SMILES:

C1(=NC(=NC(=N1)NS(=O)(=O)[O-])N)N.C1(=NC(=NC(=N1)NS(=O)(=O)[O-])N)N.[Ca+2]

Isomeric SMILES

C1(=NC(=NC(=N1)NS(=O)(=O)[O-])N)N.C1(=NC(=NC(=N1)NS(=O)(=O)[O-])N)N.[Ca+2]

InChI

InChI=1S/2C3H6N6O3S.Ca/c2*4-1-6-2(5)8-3(7-1)9-13(10,11)12;/h2*(H,10,11,12)(H5,4,5,6,7,8,9);/q;;+2/p-2