Vitas-M small molecule compound

(6Z)-6-(4-chlorobenzylidene)-3-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one

Catalog ID
STK221314
SMILES COc1cc(cc(c1OC)OC)c1nnc2n1c(=O)/c(=C/c1ccc(cc1)Cl)/s2

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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 C20H16ClN3O4S MW 429.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O4S/c1-26-14-9-12(10-15(27-2)17(14)28-3)18-22-23-20-24(18)19(25)16(29-20)8-11-4-6-13(21)7-5-11/h4-10H,1-3H3/b16-8-
InChIKey
AAVFCHGNCYSAIQ-PXNMLYILSA-N
Synonyms
497230-52-1
(6Z)6((4CHLOROPHENYL)METHYLIDENE)3(345TRIMETHOXYPHENYL)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)6(4chlorobenzylidene)3(345trimethoxyphenyl)(13)thiazolo(23c)(124)triazol5(6H)one
(Z)6(4chlorobenzylidene)3(345trimethoxyphenyl)thiazolo(23c)(124)triazol5(6H)one
497230521
COC1=CC(=CC(=C1OC)OC)C2=NN=C3N2C(=O)C(=CC4=CC=C(C=C4)Cl)S3
COc1cc(cc(c1OC)OC)c1nnc2n1c(=O)c(=Cc1ccc(cc1)Cl)s2
InChI=1SC20H16ClN3O4Sc12614912(1015(272)17(14)283)1822232024(18)19(25)16(2920)8114613(21)7511h410H13H3b168
MFCD03300610
ZINC000002343985
ZINC02343985
ZINC2343985

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Available files

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