Vitas-M small molecule compound
1-benzofuran-2-yl[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STL412222
SMILES Clc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1cc2c(o1)cccc2
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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 C19H16ClN3O4 MW 385.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O4/c20-14-5-6-15(16(12-14)23(25)26)21-7-9-22(10-8-21)19(24)18-11-13-3-1-2-4-17(13)27-18/h1-6,11-12H,7-10H2InChIKey
XYHROODOCAAYTR-UHFFFAOYSA-NSynonyms
1benzofuran2yl(4(4chloro2nitrophenyl)piperazin1yl)methanone
C1CN(CCN1C2=C(C=C(C=C2)Cl)(N+)(=O)(O))C(=O)C3=CC4=CC=CC=C4O3
Clc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1cc2c(o1)cccc2
InChI=1SC19H16ClN3O4c20145615(16(1214)23(25)26)217922(10821)19(24)181113312417(13)2718h161112H710H2
MFCD02640108
ZINC000005104299
ZINC05104299
ZINC5104299
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