Vitas-M small molecule compound

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

Catalog ID
STK704240
SMILES CCOc1cc(ccc1OC(=O)C)/C=c\1/sc2n(c1=O)nc(n2)c1ccccc1C

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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 C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-4-28-18-11-15(9-10-17(18)29-14(3)26)12-19-21(27)25-22(30-19)23-20(24-25)16-8-6-5-7-13(16)2/h5-12H,4H2,1-3H3/b19-12+
InChIKey
OXVVHNWIDHRVCV-XDHOZWIPSA-N
Synonyms

(2ETHOXY4((E)(2(2METHYLPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
(Z)2ethoxy4((6oxo2(otolyl)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
2ethoxy4((E)(2(2methylphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4C)S2)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)c1ccccc1C
InChI=1SC22H19N3O4Sc1428181115(91017(18)2914(3)26)121921(27)2522(3019)2320(2425)16865713(16)2h512H4H213H3b1912+
MFCD04446467
ZINC000026533856
ZINC26533856

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Available files

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