Vitas-M small molecule compound
4-chloro-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]-1-methyl-1H-pyrazole-5-carboxamide
Catalog ID
STK315370
SMILES S=C(NC(=O)c1c(Cl)cnn1C)Nc1ccc(cc1O)[N+](=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 C12H10ClN5O4S MW 355.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClN5O4S/c1-17-10(7(13)5-14-17)11(20)16-12(23)15-8-3-2-6(18(21)22)4-9(8)19/h2-5,19H,1H3,(H2,15,16,20,23)InChIKey
YEZLCWNAWLDJBC-UHFFFAOYSA-NSynonyms
1005595-10-71005595107
4chloroN((2hydroxy4nitrophenyl)carbamothioyl)1methyl1Hpyrazole5carboxamide
4CHLORON((2HYDROXY4NITROPHENYL)CARBAMOTHIOYL)2METHYLPYRAZOLE3CARBOXAMIDE
CN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))O
InChI=1SC12H10ClN5O4Sc11710(7(13)51417)11(20)1612(23)158326(18(21)22)49(8)19h2519H1H3(H215162023)
MFCD00849773
S=C(NC(=O)c1c(Cl)cnn1C)Nc1ccc(cc1O)(N+)(=O)(O)
ZINC000005331178
ZINC05331178
ZINC5331178
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