Vitas-M small molecule compound
N-({4-ethyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)-1,3-benzodioxole-5-carboxamide
Catalog ID
STK221903
SMILES CCn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1SCCOc1ccccc1
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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 C21H22N4O4S MW 426.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S/c1-2-25-19(13-22-20(26)15-8-9-17-18(12-15)29-14-28-17)23-24-21(25)30-11-10-27-16-6-4-3-5-7-16/h3-9,12H,2,10-11,13-14H2,1H3,(H,22,26)InChIKey
FVFJGZNSGORPIX-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCCOC2=CC=CC=C2)CNC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC21H22N4O4Sc122519(132220(26)15891718(1215)29142817)232421(25)30111027166435716h3912H210111314H21H3(H2226)
MFCD07399629
N((4ethyl5((2phenoxyethyl)sulfanyl)4H124triazol3yl)methyl)13benzodioxole5carboxamide
N((4ETHYL5(2PHENOXYETHYLSULFANYL)124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
ZINC000009302485
ZINC09302485
ZINC9302485
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