Vitas-M small molecule compound
2-({5-[(4-chloro-2-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-(2-chloro-5-nitrophenyl)ethanone
Catalog ID
STL416902
SMILES Clc1ccc(c(c1)C)OCc1nnc(o1)SCC(=O)c1cc(ccc1Cl)[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 C18H13Cl2N3O5S MW 454.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13Cl2N3O5S/c1-10-6-11(19)2-5-16(10)27-8-17-21-22-18(28-17)29-9-15(24)13-7-12(23(25)26)3-4-14(13)20/h2-7H,8-9H2,1H3InChIKey
GLQGNSNFGHOTIN-UHFFFAOYSA-NSynonyms
2((5((4chloro2methylphenoxy)methyl)134oxadiazol2yl)sulfanyl)1(2chloro5nitrophenyl)ethanone
CC1=C(C=CC(=C1)Cl)OCC2=NN=C(O2)SCC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
Clc1ccc(c(c1)C)OCc1nnc(o1)SCC(=O)c1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC18H13Cl2N3O5Sc110611(19)2516(10)27817212218(2817)29915(24)13712(23(25)26)3414(13)20h27H89H21H3
MFCD14713414
ZINC000020847228
ZINC20847228
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