Vitas-M small molecule compound
(6Z)-3-(4-methylphenyl)-6-(2,4,5-trimethoxybenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Catalog ID
STK221436
SMILES COc1cc(OC)c(cc1/C=c/1\sc2n(c1=O)c(nn2)c1ccc(cc1)C)OC
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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 C21H19N3O4S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4S/c1-12-5-7-13(8-6-12)19-22-23-21-24(19)20(25)18(29-21)10-14-9-16(27-3)17(28-4)11-15(14)26-2/h5-11H,1-4H3/b18-10-InChIKey
RCQRRVGRLAVDPQ-ZDLGFXPLSA-NSynonyms
(6Z)3(4METHYLPHENYL)6((245TRIMETHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)3(4METHYLPHENYL)6(245TRIMETHOXYBENZYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5(6H)ONE
CC1=CC=C(C=C1)C2=NN=C3N2C(=O)C(=CC4=CC(=C(C=C4OC)OC)OC)S3
COc1cc(OC)c(cc1C=c1sc2n(c1=O)c(nn2)c1ccc(cc1)C)OC
InChI=1SC21H19N3O4Sc1125713(8612)1922232124(19)20(25)18(2921)1014916(273)17(284)1115(14)262h511H14H3b1810
MFCD08673595
ZINC000003651535
ZINC03651535
ZINC3651535
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