Vitas-M small molecule compound
4-hydroxy-3-nitrobenzyl carbamimidothioate
Catalog ID
STK722644
SMILES NC(=N)SCc1ccc(c(c1)[N+](=O)[O-])O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C8H9N3O3S MW 227.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H9N3O3S/c9-8(10)15-4-5-1-2-7(12)6(3-5)11(13)14/h1-3,12H,4H2,(H3,9,10)InChIKey
XXWBWVYAPSRHPQ-UHFFFAOYSA-NSynonyms
487018-47-3(4HYDROXY3NITROPHENYL)METHYLCARBAMIMIDOTHIOATE
487018473
4hydroxy3nitrobenzylcarbamimidothioate
4hydroxy3nitrobenzylcarbamimidothioatehydrochloride
C1=CC(=C(C=C1CSC(=N)N)(N+)(=O)(O))O
InChI=1SC8H9N3O3Sc98(10)1545127(12)6(35)11(13)14h1312H4H2(H3910)
MFCD03006737
NC(=N)SCc1ccc(c(c1)(N+)(=O)(O))O
NC(=N)SCc1ccc(c(c1)(N+)(=O)(O))OCl
ZINC000020029198
ZINC20029198
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