Vitas-M small molecule compound
3-{(Z)-[2-(3,4-dimethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Catalog ID
STK800900
SMILES COc1ccc(cc1OC)c1nc2n(n1)c(=O)/c(=C/c1cccc(c1)OC(=O)C)/s2
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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 C21H17N3O5S MW 423.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O5S/c1-12(25)29-15-6-4-5-13(9-15)10-18-20(26)24-21(30-18)22-19(23-24)14-7-8-16(27-2)17(11-14)28-3/h4-11H,1-3H3/b18-10-InChIKey
ULRLQSPWUXZNDA-ZDLGFXPLSA-NSynonyms
573948-73-9(3((Z)(2(34DIMETHOXYPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
(Z)3((2(34dimethoxyphenyl)6oxothiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
3((Z)(2(34dimethoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
573948739
CC(=O)OC1=CC=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC(=C(C=C4)OC)OC)S2
COc1ccc(cc1OC)c1nc2n(n1)c(=O)c(=Cc1cccc(c1)OC(=O)C)s2
InChI=1SC21H17N3O5Sc112(25)291564513(915)101820(26)2421(3018)2219(2324)147816(272)17(1114)283h411H13H3b1810
MFCD04021211
ZINC000002245181
ZINC02245181
ZINC2245181
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