Vitas-M small molecule compound
N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}-4-ethoxy-3-nitrobenzamide
Catalog ID
STK234561
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cc(ccc1Cl)NC(=O)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 C19H19ClN4O5S MW 450.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN4O5S/c1-3-17(25)21-12-6-7-13(20)14(10-12)22-19(30)23-18(26)11-5-8-16(29-4-2)15(9-11)24(27)28/h5-10H,3-4H2,1-2H3,(H,21,25)(H2,22,23,26,30)InChIKey
WHBLHIMMPDBUOL-UHFFFAOYSA-NSynonyms
CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cc(ccc1Cl)NC(=O)CC
InChI=1SC19H19ClN4O5Sc1317(25)21126713(20)14(1012)2219(30)2318(26)115816(2942)15(911)24(27)28h510H34H212H3(H2125)(H222232630)
MFCD03999461
N((2chloro5(propanoylamino)phenyl)carbamothioyl)4ethoxy3nitrobenzamide
ZINC000009189843
ZINC09189843
ZINC9189843
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