Vitas-M small molecule compound
3-{(E)-[3,7-dioxo-6-(4-propoxybenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene]methyl}phenyl acetate
Catalog ID
STK705909
SMILES CCCOc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C/c1cccc(c1)OC(=O)C)/c2=O
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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 C24H21N3O5S MW 463.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O5S/c1-3-11-31-18-9-7-16(8-10-18)13-20-22(29)25-24-27(26-20)23(30)21(33-24)14-17-5-4-6-19(12-17)32-15(2)28/h4-10,12,14H,3,11,13H2,1-2H3/b21-14+InChIKey
HKQYUVTUSQXKOE-KGENOOAVSA-NSynonyms
(3((E)(37DIOXO6((4PROPOXYPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZIN2YLIDENE)METHYL)PHENYL)ACETATE
(Z)3((37dioxo6(4propoxybenzyl)37dihydro2Hthiazolo(32b)(124)triazin2ylidene)methyl)phenylacetate
3((E)(37dioxo6(4propoxybenzyl)7H(13)thiazolo(32b)(124)triazin2(3H)ylidene)methyl)phenylacetate
CCCOC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CC(=CC=C4)OC(=O)C)SC3=NC2=O
CCCOc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1cccc(c1)OC(=O)C)c2=O
InChI=1SC24H21N3O5Sc131131189716(81018)132022(29)252427(2620)23(30)21(3324)141754619(1217)3215(2)28h4101214H31113H212H3b2114+
MFCD04446849
ZINC000026779380
ZINC26779380
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