Vitas-M small molecule compound
N-[(4-ethyl-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-N-(4-fluorophenyl)methanesulfonamide
Catalog ID
STL365671
SMILES CCn1c(nnc1SCC(=O)N1CCCC1)CN(S(=O)(=O)C)c1ccc(cc1)F
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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 C18H24FN5O3S2 MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24FN5O3S2/c1-3-23-16(12-24(29(2,26)27)15-8-6-14(19)7-9-15)20-21-18(23)28-13-17(25)22-10-4-5-11-22/h6-9H,3-5,10-13H2,1-2H3InChIKey
GRCQTFXDMPDVBG-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)N2CCCC2)CN(C3=CC=C(C=C3)F)S(=O)(=O)C
InChI=1SC18H24FN5O3S2c132316(1224(29(226)27)158614(19)7915)202118(23)281317(25)2210451122h69H351013H212H3
MFCD27591722
N((4ethyl5((2oxo2(pyrrolidin1yl)ethyl)sulfanyl)4H124triazol3yl)methyl)N(4fluorophenyl)methanesulfonamide
N((4ethyl5(2oxo2pyrrolidin1ylethyl)sulfanyl124triazol3yl)methyl)N(4fluorophenyl)methanesulfonamide
ZINC000020416289
ZINC20416289
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