Vitas-M small molecule compound
2-({5-[(2,4-dichlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(pyrrolidin-1-yl)ethanone
Catalog ID
STL376835
SMILES Clc1ccc(c(c1)Cl)OCc1nnc(n1C)SCC(=O)N1CCCC1
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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 C16H18Cl2N4O2S MW 401.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18Cl2N4O2S/c1-21-14(9-24-13-5-4-11(17)8-12(13)18)19-20-16(21)25-10-15(23)22-6-2-3-7-22/h4-5,8H,2-3,6-7,9-10H2,1H3InChIKey
ALFLZUPWISYONC-UHFFFAOYSA-NSynonyms
2((5((24DICHLOROPHENOXY)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)1PYRROLIDIN1YLETHANONE
2((5((24dichlorophenoxy)methyl)4methyl4H124triazol3yl)sulfanyl)1(pyrrolidin1yl)ethanone
CN1C(=NN=C1SCC(=O)N2CCCC2)COC3=C(C=C(C=C3)Cl)Cl
InChI=1SC16H18Cl2N4O2Sc12114(924135411(17)812(13)18)192016(21)251015(23)22623722h458H2367910H21H3
MFCD07395815
ZINC000005059685
ZINC05059685
ZINC5059685
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