Vitas-M small molecule compound
(6Z)-6-(4-ethoxy-3-methoxybenzylidene)-3-(3-methylphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Catalog ID
STK794571
SMILES CCOc1ccc(cc1OC)/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 C21H19N3O3S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3S/c1-4-27-16-9-8-14(11-17(16)26-3)12-18-20(25)24-19(22-23-21(24)28-18)15-7-5-6-13(2)10-15/h5-12H,4H2,1-3H3/b18-12-InChIKey
LVVUWLOVJKUXPY-PDGQHHTCSA-NSynonyms
(6Z)6((4ETHOXY3METHOXYPHENYL)METHYLIDENE)3(3METHYLPHENYL)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)6(4ethoxy3methoxybenzylidene)3(3methylphenyl)(13)thiazolo(23c)(124)triazol5(6H)one
CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NN=C3S2)C4=CC(=CC=C4)C)OC
CCOc1ccc(cc1OC)C=c1sc2n(c1=O)c(nn2)c1cccc(c1)C
InChI=1SC21H19N3O3Sc1427169814(1117(16)263)121820(25)2419(222321(24)2818)1575613(2)1015h512H4H213H3b1812
MFCD05855581
ZINC000004694798
ZINC04694798
ZINC4694798
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