Vitas-M small molecule compound
N-[(5-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK221902
SMILES Clc1ccc(cc1)OCCSc1nnc(n1C)CNC(=O)c1ccc2c(c1)OCO2
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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 C20H19ClN4O4S MW 446.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O4S/c1-25-18(11-22-19(26)13-2-7-16-17(10-13)29-12-28-16)23-24-20(25)30-9-8-27-15-5-3-14(21)4-6-15/h2-7,10H,8-9,11-12H2,1H3,(H,22,26)InChIKey
WMQRISIXDIUQLF-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCCOC2=CC=C(C=C2)Cl)CNC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC20H19ClN4O4Sc12518(112219(26)13271617(1013)29122816)232420(25)309827155314(21)4615h2710H891112H21H3(H2226)
MFCD07399627
N((5((2(4chlorophenoxy)ethyl)sulfanyl)4methyl4H124triazol3yl)methyl)13benzodioxole5carboxamide
N((5(2(4CHLOROPHENOXY)ETHYLSULFANYL)4METHYL124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
ZINC000009302484
ZINC09302484
ZINC9302484
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