Vitas-M small molecule compound
N-[(4-ethyl-5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-N-(4-fluorophenyl)methanesulfonamide
Catalog ID
STL365692
SMILES CCn1c(SCC(=O)N2CCC(CC2)C)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 C20H28FN5O3S2 MW 469.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28FN5O3S2/c1-4-25-18(13-26(31(3,28)29)17-7-5-16(21)6-8-17)22-23-20(25)30-14-19(27)24-11-9-15(2)10-12-24/h5-8,15H,4,9-14H2,1-3H3InChIKey
GSSMQAICOWECON-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)N2CCC(CC2)C)CN(C3=CC=C(C=C3)F)S(=O)(=O)C
InChI=1SC20H28FN5O3S2c142518(1326(31(328)29)177516(21)6817)222320(25)301419(27)2411915(2)101224h5815H4914H213H3
MFCD27593917
N((4ethyl5((2(4methylpiperidin1yl)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)N(4fluorophenyl)methanesulfonamide
N((4ethyl5(2(4methylpiperidin1yl)2oxoethyl)sulfanyl124triazol3yl)methyl)N(4fluorophenyl)methanesulfonamide
ZINC000020416337
ZINC20416337
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