Vitas-M small molecule compound
3-chloro-4-ethoxy-N-[(2-methoxy-4-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK148558
SMILES CCOc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(cc1OC)[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 C17H16ClN3O5S MW 409.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O5S/c1-3-26-14-7-4-10(8-12(14)18)16(22)20-17(27)19-13-6-5-11(21(23)24)9-15(13)25-2/h4-9H,3H2,1-2H3,(H2,19,20,22,27)InChIKey
STECIQGCHPGUKQ-UHFFFAOYSA-NSynonyms
3CHLORO4ETHOXYN((2METHOXY4NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))OC)Cl
CCOc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc(cc1OC)(N+)(=O)(O)
InChI=1SC17H16ClN3O5Sc1326147410(812(14)18)16(22)2017(27)19136511(21(23)24)915(13)252h49H3H212H3(H219202227)
MFCD02820978
ZINC000004687353
ZINC04687353
ZINC4687353
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