Vitas-M small molecule compound

3-[14-(4-methoxyphenyl)-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-2-yl]naphthalen-2-olate

Catalog ID
STL051007
SMILES COc1ccc(cc1)C1c2c(ccc3c2cccc3)Oc2c1c1nc([nH+]n1cn2)c1cc2ccccc2cc1[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 C33H22N4O3 MW 522.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H22N4O3/c1-39-23-13-10-20(11-14-23)28-29-24-9-5-4-6-19(24)12-15-27(29)40-33-30(28)32-35-31(36-37(32)18-34-33)25-16-21-7-2-3-8-22(21)17-26(25)38/h2-18,28,38H,1H3
InChIKey
DPPJHBIBAHCDLM-UHFFFAOYSA-N
Synonyms
843671-27-2
3(14(4methoxyphenyl)14Hbenzo(56)chromeno(32e)(124)triazolo(15c)pyrimidin3ium2yl)naphthalen2olate
843671272
COc1ccc(cc1)C1c2c(ccc3c2cccc3)Oc2c1c1nc((nH+)n1cn2)c1cc2ccccc2cc1(O)
MFCD04163203
ZINC000101105034

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Available files

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