Vitas-M small molecule compound
2-{(5Z)-5-[3-methoxy-4-(2-methylpropoxy)benzylidene]-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenyl acetate
Catalog ID
STK815996
SMILES COc1cc(ccc1OCC(C)C)/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1OC(=O)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 C24H23N3O5S MW 465.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5S/c1-14(2)13-31-19-10-9-16(11-20(19)30-4)12-21-23(29)27-24(33-21)25-22(26-27)17-7-5-6-8-18(17)32-15(3)28/h5-12,14H,13H2,1-4H3/b21-12-InChIKey
BAWMRVBLUGCRSR-MTJSOVHGSA-NSynonyms
(2((5Z)5((3METHOXY4(2METHYLPROPOXY)PHENYL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
2((5Z)5(3methoxy4(2methylpropoxy)benzylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
CC(C)COC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4OC(=O)C)S2)OC
COc1cc(ccc1OCC(C)C)C=c1sc2n(c1=O)nc(n2)c1ccccc1OC(=O)C
InChI=1SC24H23N3O5Sc114(2)13311910916(1120(19)304)122123(29)2724(3321)2522(2627)17756818(17)3215(3)28h51214H13H214H3b2112
MFCD03533513
ZINC000016732992
ZINC16732992
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