Vitas-M small molecule compound
4-chloro-N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Catalog ID
STK961484
SMILES S=C(NC(=O)c1n(C)nc(c1Cl)C)Nc1cc(cc(c1O)Cl)[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 C13H11Cl2N5O4S MW 404.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11Cl2N5O4S/c1-5-9(15)10(19(2)18-5)12(22)17-13(25)16-8-4-6(20(23)24)3-7(14)11(8)21/h3-4,21H,1-2H3,(H2,16,17,22,25)InChIKey
SFSQDNJLVRHGGF-UHFFFAOYSA-NSynonyms
494746-48-4494746484
4chloroN((3chloro2hydroxy5nitrophenyl)carbamothioyl)13dimethyl1Hpyrazole5carboxamide
4CHLORON((3CHLORO2HYDROXY5NITROPHENYL)CARBAMOTHIOYL)25DIMETHYLPYRAZOLE3CARBOXAMIDE
CC1=NN(C(=C1Cl)C(=O)NC(=S)NC2=CC(=CC(=C2O)Cl)(N+)(=O)(O))C
InChI=1SC13H11Cl2N5O4Sc159(15)10(19(2)185)12(22)1713(25)16846(20(23)24)37(14)11(8)21h3421H12H3(H216172225)
MFCD02374332
N((4CHLORO13DIMETHYL1HPYRAZOL5YL)CARBONYL)N(3CHLORO2HYDROXY5NITROPHENYL)THIOUREA
S=C(NC(=O)c1n(C)nc(c1Cl)C)Nc1cc(cc(c1O)Cl)(N+)(=O)(O)
ZINC000002776569
ZINC2776569
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