Vitas-M small molecule compound
3-[7-(5-chloro-2-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]phenol
Catalog ID
STL344996
SMILES Oc1cccc(c1)c1nnc2n1cnc1c2cnn1c1cc(Cl)ccc1C
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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 C19H13ClN6O MW 376.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN6O/c1-11-5-6-13(20)8-16(11)26-18-15(9-22-26)19-24-23-17(25(19)10-21-18)12-3-2-4-14(27)7-12/h2-10,27H,1H3InChIKey
MBRKZDFLTJPNNO-UHFFFAOYSA-NSynonyms
847163-44-43(7(5chloro2methylphenyl)7Hpyrazolo(43e)(124)triazolo(43c)pyrimidin3yl)phenol
847163444
CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C4=NN=C(N4C=N3)C5=CC(=CC=C5)O
InChI=1SC19H13ClN6Oc1115613(20)816(11)261815(92226)19242317(25(19)102118)1232414(27)712h21027H1H3
MFCD04183143
ZINC000005164103
ZINC05164103
ZINC5164103
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