Vitas-M small molecule compound
1-(2-chloro-5-nitrophenyl)-2-{[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethanone
Catalog ID
STK239047
SMILES O=C(c1cc(ccc1Cl)[N+](=O)[O-])CSc1nnc(o1)COc1ccccc1
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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 C17H12ClN3O5S MW 405.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3O5S/c18-14-7-6-11(21(23)24)8-13(14)15(22)10-27-17-20-19-16(26-17)9-25-12-4-2-1-3-5-12/h1-8H,9-10H2InChIKey
WKBGHWJCKCQMIT-UHFFFAOYSA-NSynonyms
1(2CHLORO5NITROPHENYL)2((5(PHENOXYMETHYL)134OXADIAZOL2YL)SULFANYL)ETHANONE
C1=CC=C(C=C1)OCC2=NN=C(O2)SCC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
InChI=1SC17H12ClN3O5Sc18147611(21(23)24)813(14)15(22)102717201916(2617)925124213512h18H910H2
MFCD08672587
O=C(c1cc(ccc1Cl)(N+)(=O)(O))CSc1nnc(o1)COc1ccccc1
ZINC000007342101
ZINC07342101
ZINC7342101
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