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sodium 4-oxidanylidene-2-sulfo-4-(1,3,4-thiadiazol-2-ylamino)butanoate

sodium 4-oxidanylidene-2-sulfo-4-(1,3,4-thiadiazol-2-ylamino)butanoate

Systemtic Name:sodium 4-oxidanylidene-2-sulfo-4-(1,3,4-thiadiazol-2-ylamino)butanoate
Openeye Name:sodium 4-oxo-2-sulfo-4-(1,3,4-thiadiazol-2-ylamino)butanoate
CAS Name:sodium 4-oxo-2-sulfo-4-(1,3,4-thiadiazol-2-ylamino)butanoate
IUPAC Name:sodium 4-oxo-2-sulfo-4-(1,3,4-thiadiazol-2-ylamino)butanoate
Traditional Name:sodium 4-keto-2-sulfo-4-(1,3,4-thiadiazol-2-ylamino)butyrate
Formula: C6H6N3NaO6S2
MolecularWeight: 303.24811
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Descriptors Computed from Structure

Canonical SMILES:

C1=NN=C(S1)NC(=O)CC(C(=O)[O-])S(=O)(=O)O.[Na+]


Isomeric SMILES

C1=NN=C(S1)NC(=O)CC(C(=O)[O-])S(=O)(=O)O.[Na+]


InChI

InChI=1S/C6H7N3O6S2.Na/c10-4(8-6-9-7-2-16-6)1-3(5(11)12)17(13,14)15;/h2-3H,1H2,(H,11,12)(H,8,9,10)(H,13,14,15);/q;+1/p-1


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