Vitas-M small molecule compound
3-[(5Z)-5-(3,4-dimethoxybenzylidene)-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]naphthalen-2-yl acetate
Catalog ID
STK809343
SMILES COc1cc(ccc1OC)/C=c/1\sc2n(c1=O)nc(n2)c1cc2ccccc2cc1OC(=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 C25H19N3O5S MW 473.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O5S/c1-14(29)33-20-13-17-7-5-4-6-16(17)12-18(20)23-26-25-28(27-23)24(30)22(34-25)11-15-8-9-19(31-2)21(10-15)32-3/h4-13H,1-3H3/b22-11-InChIKey
OLLMQPYZKSGDMD-JJFYIABZSA-NSynonyms
(3((5Z)5((34DIMETHOXYPHENYL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)NAPHTHALEN2YL)ACETATE
3((5Z)5(34dimethoxybenzylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)naphthalen2ylacetate
CC(=O)OC1=CC2=CC=CC=C2C=C1C3=NN4C(=O)C(=CC5=CC(=C(C=C5)OC)OC)SC4=N3
COc1cc(ccc1OC)C=c1sc2n(c1=O)nc(n2)c1cc2ccccc2cc1OC(=O)C
InChI=1SC25H19N3O5Sc114(29)33201317754616(17)1218(20)23262528(2723)24(30)22(3425)11158919(312)21(1015)323h413H13H3b2211
MFCD03461310
ZINC000000638126
ZINC00638126
ZINC638126
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