Vitas-M small molecule compound
(6Z)-3-(3-methylphenyl)-6-(3,4,5-trimethoxybenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Catalog ID
STL430478
SMILES COc1cc(cc(c1OC)OC)/C=c/1\sc2n(c1=O)c(nn2)c1cccc(c1)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 C21H19N3O4S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4S/c1-12-6-5-7-14(8-12)19-22-23-21-24(19)20(25)17(29-21)11-13-9-15(26-2)18(28-4)16(10-13)27-3/h5-11H,1-4H3/b17-11-InChIKey
OAOJLQZMNBTFBO-BOPFTXTBSA-NSynonyms
(6Z)3(3METHYLPHENYL)6((345TRIMETHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)3(3methylphenyl)6(345trimethoxybenzylidene)(13)thiazolo(23c)(124)triazol5(6H)one
CC1=CC=CC(=C1)C2=NN=C3N2C(=O)C(=CC4=CC(=C(C(=C4)OC)OC)OC)S3
COc1cc(cc(c1OC)OC)C=c1sc2n(c1=O)c(nn2)c1cccc(c1)C
InChI=1SC21H19N3O4Sc11265714(812)1922232124(19)20(25)17(2921)1113915(262)18(284)16(1013)273h511H14H3b1711
MFCD04348201
ZINC000003648118
ZINC03648118
ZINC3648118
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