Vitas-M small molecule compound
(5Z)-5-(4-butoxy-3-ethoxybenzylidene)-2-[(E)-2-phenylethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904303
SMILES CCCCOc1ccc(cc1OCC)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccccc1
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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 C25H25N3O3S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S/c1-3-5-15-31-20-13-11-19(16-21(20)30-4-2)17-22-24(29)28-25(32-22)26-23(27-28)14-12-18-9-7-6-8-10-18/h6-14,16-17H,3-5,15H2,1-2H3/b14-12+,22-17-InChIKey
SNHLAYUECMNHHA-KOEIGMAUSA-NSynonyms
(5Z)5((4butoxy3ethoxyphenyl)methylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6one
(5Z)5(4butoxy3ethoxybenzylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=CC=C4)S2)OCC
CCCCOc1ccc(cc1OCC)C=c1sc2n(c1=O)nc(n2)C=Cc1ccccc1
InChI=1SC25H25N3O3Sc135153120131119(1621(20)3042)172224(29)2825(3222)2623(2728)14121897681018h6141617H3515H212H3b1412+2217
MFCD18076036
ZINC000027021782
ZINC27021782
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