Vitas-M small molecule compound
(6Z)-3-(4-tert-butylphenyl)-6-(2,4-dimethoxybenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Catalog ID
STK877676
SMILES COc1ccc(c(c1)OC)/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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-23(2,3)16-9-6-14(7-10-16)20-24-25-22-26(20)21(27)19(30-22)12-15-8-11-17(28-4)13-18(15)29-5/h6-13H,1-5H3/b19-12-InChIKey
HRZSBEHRCPLCQM-UNOMPAQXSA-NSynonyms
(6Z)3(4TERTBUTYLPHENYL)6((24DIMETHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)3(4tertbutylphenyl)6(24dimethoxybenzylidene)(13)thiazolo(23c)(124)triazol5(6H)one
(E)3(4(tertbutyl)phenyl)6(24dimethoxybenzylidene)thiazolo(23c)(124)triazol5(6H)one
CC(C)(C)C1=CC=C(C=C1)C2=NN=C3N2C(=O)C(=CC4=C(C=C(C=C4)OC)OC)S3
COc1ccc(c(c1)OC)C=c1sc2n(c1=O)c(nn2)c1ccc(cc1)C(C)(C)C
InChI=1SC23H23N3O3Sc123(23)169614(71016)2024252226(20)21(27)19(3022)121581117(284)1318(15)295h613H15H3b1912
MFCD14710886
ZINC000003672693
ZINC03672693
ZINC3672693
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