Vitas-M small molecule compound
4-chloro-1,3-dimethyl-N-[(2-nitrophenyl)carbamothioyl]-1H-pyrazole-5-carboxamide
Catalog ID
STK961576
SMILES S=C(Nc1ccccc1[N+](=O)[O-])NC(=O)c1n(C)nc(c1Cl)C
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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 C13H12ClN5O3S MW 353.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClN5O3S/c1-7-10(14)11(18(2)17-7)12(20)16-13(23)15-8-5-3-4-6-9(8)19(21)22/h3-6H,1-2H3,(H2,15,16,20,23)InChIKey
BYOZIWMVEULKMV-UHFFFAOYSA-NSynonyms
515874-50-74chloro13dimethylN((2nitrophenyl)carbamothioyl)1Hpyrazole5carboxamide
4CHLORO25DIMETHYLN((2NITROPHENYL)CARBAMOTHIOYL)PYRAZOLE3CARBOXAMIDE
515874507
CC1=NN(C(=C1Cl)C(=O)NC(=S)NC2=CC=CC=C2(N+)(=O)(O))C
InChI=1SC13H12ClN5O3Sc1710(14)11(18(2)177)12(20)1613(23)15853469(8)19(21)22h36H12H3(H215162023)
MFCD02609341
N((4CHLORO13DIMETHYL1HPYRAZOL5YL)CARBONYL)N(2NITROPHENYL)THIOUREA
S=C(Nc1ccccc1(N+)(=O)(O))NC(=O)c1n(C)nc(c1Cl)C
ZINC000005587162
ZINC05587162
ZINC5587162
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