Vitas-M small molecule compound

4-{(E)-[2-(4-chlorophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}-2-ethoxyphenyl acetate

Catalog ID
STK701583
SMILES CCOc1cc(ccc1OC(=O)C)/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1)Cl

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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 C21H16ClN3O4S MW 441.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O4S/c1-3-28-17-10-13(4-9-16(17)29-12(2)26)11-18-20(27)25-21(30-18)23-19(24-25)14-5-7-15(22)8-6-14/h4-11H,3H2,1-2H3/b18-11+
InChIKey
NQPMEOZMNQERDI-WOJGMQOQSA-N
Synonyms
373375-24-7
(4((E)(2(4CHLOROPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)2ETHOXYPHENYL)ACETATE
(E)4((2(4chlorophenyl)6oxothiazolo(32b)(124)triazol5(6H)ylidene)methyl)2ethoxyphenylacetate
373375247
4((E)(2(4chlorophenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)2ethoxyphenylacetate
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)Cl)S2)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)Cl
InChI=1SC21H16ClN3O4Sc1328171013(4916(17)2912(2)26)111820(27)2521(3018)2319(2425)145715(22)8614h411H3H212H3b1811+
MFCD01946405
ZINC000013766346
ZINC13766346

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Available files

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