Vitas-M small molecule compound

2-[14-(4-methoxyphenyl)-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-3-ium-2-yl]phenolate

Catalog ID
STL057279
SMILES COc1ccc(cc1)C1c2ccc3c(c2Oc2c1c1nc([nH+]n1cn2)c1ccccc1[O-])cccc3

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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 C29H20N4O3 MW 472.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20N4O3/c1-35-19-13-10-18(11-14-19)24-22-15-12-17-6-2-3-7-20(17)26(22)36-29-25(24)28-31-27(32-33(28)16-30-29)21-8-4-5-9-23(21)34/h2-16,24,34H,1H3
InChIKey
YSIHKVHFTAGTIS-UHFFFAOYSA-N
Synonyms
848869-16-9
2(14(4methoxyphenyl)14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin3ium2yl)phenolate
848869169
COc1ccc(cc1)C1c2ccc3c(c2Oc2c1c1nc((nH+)n1cn2)c1ccccc1(O))cccc3
MFCD04197456
ZINC000009350971

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Available files

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