Vitas-M small molecule compound
2-methoxy-4-{(Z)-[6-oxo-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Catalog ID
STK815827
SMILES COc1cc(ccc1OC(=O)C)/C=c/1\sc2n(c1=O)nc(n2)c1cccs1
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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 C18H13N3O4S2 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O4S2/c1-10(22)25-12-6-5-11(8-13(12)24-2)9-15-17(23)21-18(27-15)19-16(20-21)14-4-3-7-26-14/h3-9H,1-2H3/b15-9-InChIKey
IIGNGELQWBLYNY-DHDCSXOGSA-NSynonyms
(2METHOXY4((Z)(6OXO2THIOPHEN2YL(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
2methoxy4((Z)(6oxo2(thiophen2yl)(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=CS4)S2)OC
COc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)c1cccs1
InChI=1SC18H13N3O4S2c110(22)25126511(813(12)242)91517(23)2118(2715)1916(2021)144372614h39H12H3b159
MFCD03532986
ZINC000016732836
ZINC16732836
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