Vitas-M small molecule compound
2-methoxy-4-{(E)-[2-(3-nitrophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Catalog ID
STK034496
SMILES COc1cc(ccc1OC(=O)C)/C=c\1/sc2n(c1=O)nc(n2)c1cccc(c1)[N+](=O)[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 C20H14N4O6S MW 438.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O6S/c1-11(25)30-15-7-6-12(8-16(15)29-2)9-17-19(26)23-20(31-17)21-18(22-23)13-4-3-5-14(10-13)24(27)28/h3-10H,1-2H3/b17-9+InChIKey
JNEMDZOLIGFRFH-RQZCQDPDSA-NSynonyms
324563-98-6(2METHOXY4((E)(2(3NITROPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
(E)2methoxy4((2(3nitrophenyl)6oxothiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
2METHOXY4((E)(2(3NITROPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5(6H)YLIDENE)METHYL)PHENYLACETATE
324563986
CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC(=CC=C4)(N+)(=O)(O))S2)OC
COc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H14N4O6Sc111(25)30157612(816(15)292)91719(26)2320(3117)2118(2223)1343514(1013)24(27)28h310H12H3b179+
MFCD01458874
STK034496
ZINC000001763273
ZINC01763273
ZINC1763273
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