Vitas-M small molecule compound
(5Z)-5-(4-propoxybenzylidene)-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK816314
SMILES CCCOc1ccc(cc1)/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)OCCC
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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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-3-13-28-18-9-5-16(6-10-18)15-20-22(27)26-23(30-20)24-21(25-26)17-7-11-19(12-8-17)29-14-4-2/h5-12,15H,3-4,13-14H2,1-2H3/b20-15-InChIKey
PQDSIBOSOWBLQE-HKWRFOASSA-NSynonyms
(5Z)2(4PROPOXYPHENYL)5((4PROPOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(4propoxybenzylidene)2(4propoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCOC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCCC)S2
CCCOc1ccc(cc1)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)OCCC
InChI=1SC23H23N3O3Sc131328189516(61018)152022(27)2623(3020)2421(2526)1771119(12817)291442h51215H341314H212H3b2015
MFCD03532833
ZINC000003636926
ZINC03636926
ZINC3636926
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