Vitas-M small molecule compound
N-[2-(naphthalen-1-yloxy)ethyl]-2-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}acetamide
Catalog ID
STK795216
SMILES O=C(CSc1ccc(cc1[N+](=O)[O-])C(F)(F)F)NCCOc1cccc2c1cccc2
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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 C21H17F3N2O4S MW 450.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F3N2O4S/c22-21(23,24)15-8-9-19(17(12-15)26(28)29)31-13-20(27)25-10-11-30-18-7-3-5-14-4-1-2-6-16(14)18/h1-9,12H,10-11,13H2,(H,25,27)InChIKey
GSSSWUNJZSJWHX-UHFFFAOYSA-NSynonyms
C1=CC=C2C(=C1)C=CC=C2OCCNC(=O)CSC3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
InChI=1SC21H17F3N2O4Sc2221(2324)158919(17(1215)26(28)29)311320(27)251011301873514412616(14)18h1912H101113H2(H2527)
MFCD00759380
N(2(naphthalen1yloxy)ethyl)2((2nitro4(trifluoromethyl)phenyl)sulfanyl)acetamide
N(2NAPHTHALEN1YLOXYETHYL)2(2NITRO4(TRIFLUOROMETHYL)PHENYL)SULFANYLACETAMIDE
O=C(CSc1ccc(cc1(N+)(=O)(O))C(F)(F)F)NCCOc1cccc2c1cccc2
ZINC000003095318
ZINC03095318
ZINC3095318
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