Vitas-M small molecule compound
2-(4-ethylphenoxy)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]acetamide
Catalog ID
STK125894
SMILES CCc1ccc(cc1)OCC(=O)NC(=S)Nc1ccc(cc1O)[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 C17H17N3O5S MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O5S/c1-2-11-3-6-13(7-4-11)25-10-16(22)19-17(26)18-14-8-5-12(20(23)24)9-15(14)21/h3-9,21H,2,10H2,1H3,(H2,18,19,22,26)InChIKey
XHBRJURVFVOPGO-UHFFFAOYSA-NSynonyms
2(4ETHYLPHENOXY)N((2HYDROXY4NITROPHENYL)CARBAMOTHIOYL)ACETAMIDE
CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))O
CCc1ccc(cc1)OCC(=O)NC(=S)Nc1ccc(cc1O)(N+)(=O)(O)
InChI=1SC17H17N3O5Sc12113613(7411)251016(22)1917(26)18148512(20(23)24)915(14)21h3921H210H21H3(H218192226)
MFCD03590853
ZINC000004676679
ZINC04676679
ZINC4676679
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