Vitas-M small molecule compound
4-bromo-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]-1-ethyl-1H-pyrazole-3-carboxamide
Catalog ID
STK955809
SMILES CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)NC(=O)c1nn(cc1Br)CC
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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 C15H16BrN5O4S MW 442.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrN5O4S/c1-3-20-8-10(16)13(19-20)14(22)18-15(26)17-11-6-5-9(25-4-2)7-12(11)21(23)24/h5-8H,3-4H2,1-2H3,(H2,17,18,22,26)InChIKey
PUKNLHKWHKXKMX-UHFFFAOYSA-NSynonyms
494745-76-5(4BROMO1ETHYLPYRAZOL3YL)N(((4ETHOXY2NITROPHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
494745765
4bromoN((4ethoxy2nitrophenyl)carbamothioyl)1ethyl1Hpyrazole3carboxamide
4BROMON((4ETHOXY2NITROPHENYL)CARBAMOTHIOYL)1ETHYLPYRAZOLE3CARBOXAMIDE
CCN1C=C(C(=N1)C(=O)NC(=S)NC2=C(C=C(C=C2)OCC)(N+)(=O)(O))Br
CCOc1ccc(c(c1)(N+)(=O)(O))NC(=S)NC(=O)c1nn(cc1Br)CC
InChI=1SC15H16BrN5O4Sc1320810(16)13(1920)14(22)1815(26)1711659(2542)712(11)21(23)24h58H34H212H3(H217182226)
MFCD02604940
ZINC000008782549
ZINC08782549
ZINC8782549
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