Vitas-M small molecule compound
(7Z)-7-(3-bromo-5-methoxy-4-propoxybenzylidene)-3-methyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STL177156
SMILES CCCOc1c(Br)cc(cc1OC)/C=c/1\sc2nnc(n2nc1c1ccccc1)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 C22H21BrN4O2S MW 485.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN4O2S/c1-4-10-29-21-17(23)11-15(12-18(21)28-3)13-19-20(16-8-6-5-7-9-16)26-27-14(2)24-25-22(27)30-19/h5-9,11-13H,4,10H2,1-3H3/b19-13-InChIKey
FQWSYVOSEDNHDE-UYRXBGFRSA-NSynonyms
827593-17-9(7Z)7((3BROMO5METHOXY4PROPOXYPHENYL)METHYLIDENE)3METHYL6PHENYL(124)TRIAZOLO(34B)(134)THIADIAZINE
(7Z)7(3bromo5methoxy4propoxybenzylidene)3methyl6phenyl7H(124)triazolo(34b)(134)thiadiazine
827593179
CCCOC1=C(C=C(C=C1Br)C=C2C(=NN3C(=NN=C3S2)C)C4=CC=CC=C4)OC
CCCOc1c(Br)cc(cc1OC)C=c1sc2nnc(n2nc1c1ccccc1)C
InChI=1SC22H21BrN4O2Sc1410292117(23)1115(1218(21)283)131920(168657916)262714(2)242522(27)3019h591113H410H213H3b1913
MFCD04051616
ZINC000020608402
ZINC20608402
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