Vitas-M small molecule compound
(6Z)-3-(4-tert-butylphenyl)-6-(2-chlorobenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Catalog ID
STK762503
SMILES Clc1ccccc1/C=c/1\sc2n(c1=O)c(nn2)c1ccc(cc1)C(C)(C)C
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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 C21H18ClN3OS MW 395.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3OS/c1-21(2,3)15-10-8-13(9-11-15)18-23-24-20-25(18)19(26)17(27-20)12-14-6-4-5-7-16(14)22/h4-12H,1-3H3/b17-12-InChIKey
FVPNECHWWNHMED-ATVHPVEESA-NSynonyms
(6Z)3(4TERTBUTYLPHENYL)6((2CHLOROPHENYL)METHYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)3(4tertbutylphenyl)6(2chlorobenzylidene)(13)thiazolo(23c)(124)triazol5(6H)one
CC(C)(C)C1=CC=C(C=C1)C2=NN=C3N2C(=O)C(=CC4=CC=CC=C4Cl)S3
Clc1ccccc1C=c1sc2n(c1=O)c(nn2)c1ccc(cc1)C(C)(C)C
InChI=1SC21H18ClN3OSc121(23)1510813(91115)1823242025(18)19(26)17(2720)1214645716(14)22h412H13H3b1712
MFCD01618517
ZINC000003671215
ZINC03671215
ZINC3671215
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