Vitas-M small molecule compound
N-[(3-chloro-2-hydroxy-5-nitrophenyl)carbamothioyl]-1-ethyl-1H-pyrazole-4-carboxamide
Catalog ID
STK961478
SMILES CCn1ncc(c1)C(=O)NC(=S)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 C13H12ClN5O4S MW 369.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClN5O4S/c1-2-18-6-7(5-15-18)12(21)17-13(24)16-10-4-8(19(22)23)3-9(14)11(10)20/h3-6,20H,2H2,1H3,(H2,16,17,21,24)InChIKey
JFAQMNLMFKFARQ-UHFFFAOYSA-NSynonyms
494746-46-2494746462
CCN1C=C(C=N1)C(=O)NC(=S)NC2=CC(=CC(=C2O)Cl)(N+)(=O)(O)
CCn1ncc(c1)C(=O)NC(=S)Nc1cc(cc(c1O)Cl)(N+)(=O)(O)
InChI=1SC13H12ClN5O4Sc121867(51518)12(21)1713(24)161048(19(22)23)39(14)11(10)20h3620H2H21H3(H216172124)
MFCD02374291
N((3chloro2hydroxy5nitrophenyl)carbamothioyl)1ethyl1Hpyrazole4carboxamide
N((3CHLORO2HYDROXY5NITROPHENYL)CARBAMOTHIOYL)1ETHYLPYRAZOLE4CARBOXAMIDE
N(3CHLORO2HYDROXY5NITROPHENYL)N((1ETHYL1HPYRAZOL4YL)CARBONYL)THIOUREA
ZINC000002776418
ZINC2776418
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