Vitas-M small molecule compound
N-({4-methyl-5-[(2-oxo-2-phenylethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)-1,3-benzodioxole-5-carboxamide
Catalog ID
STK261094
SMILES Cn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1SCC(=O)c1ccccc1
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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 C20H18N4O4S MW 410.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4S/c1-24-18(10-21-19(26)14-7-8-16-17(9-14)28-12-27-16)22-23-20(24)29-11-15(25)13-5-3-2-4-6-13/h2-9H,10-12H2,1H3,(H,21,26)InChIKey
UCGSPSMGMWDCTB-UHFFFAOYSA-NSynonyms
BENZO(13)DIOXOLE5CARBOXYLICACID(4METHYL5(2OXO2PHENYLETHYLSULFANYL)4H(124)TRIAZOL3YLMETHYL)AMIDE
CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CNC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC20H18N4O4Sc12418(102119(26)14781617(914)28122716)222320(24)291115(25)135324613h29H1012H21H3(H2126)
MFCD08670463
N((4METHYL5((2OXO2PHENYLETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
N((4methyl5phenacylsulfanyl124triazol3yl)methyl)13benzodioxole5carboxamide
ZINC000009426786
ZINC09426786
ZINC9426786
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