Vitas-M small molecule compound
N-(4-fluorophenyl)-N-({5-[(2-oxo-2-phenylethyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}methyl)methanesulfonamide
Catalog ID
STL365716
SMILES C=CCn1c(SCC(=O)c2ccccc2)nnc1CN(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 C21H21FN4O3S2 MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN4O3S2/c1-3-13-25-20(14-26(31(2,28)29)18-11-9-17(22)10-12-18)23-24-21(25)30-15-19(27)16-7-5-4-6-8-16/h3-12H,1,13-15H2,2H3InChIKey
ROAWNWWNTOAOGP-UHFFFAOYSA-NSynonyms
CS(=O)(=O)N(CC1=NN=C(N1CC=C)SCC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)F
InChI=1SC21H21FN4O3S2c13132520(1426(31(228)29)1811917(22)101218)232421(25)301519(27)167546816h312H11315H22H3
MFCD27593940
N(4fluorophenyl)N((5((2oxo2phenylethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)methyl)methanesulfonamide
N(4fluorophenyl)N((5phenacylsulfanyl4prop2enyl124triazol3yl)methyl)methanesulfonamide
ZINC000020416404
ZINC20416404
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