Vitas-M small molecule compound
6-amino-3-(1,3-benzodioxol-5-yl)-4-{4-[(2-fluorobenzyl)oxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK764869
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccccc1F)c(n[nH]2)c1ccc2c(c1)OCO2
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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 C27H19FN4O4 MW 482.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19FN4O4/c28-20-4-2-1-3-17(20)13-33-18-8-5-15(6-9-18)23-19(12-29)26(30)36-27-24(23)25(31-32-27)16-7-10-21-22(11-16)35-14-34-21/h1-11,23H,13-14,30H2,(H,31,32)InChIKey
WMSCLOSVNGUANL-UHFFFAOYSA-NSynonyms
6amino3(13benzodioxol5yl)4(4((2fluorobenzyl)oxy)phenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO3(13BENZODIOXOL5YL)4(4((2FLUOROPHENYL)METHOXY)PHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
C1OC2=C(O1)C=C(C=C2)C3=C4C(C(=C(OC4=NN3)N)C#N)C5=CC=C(C=C5)OCC6=CC=CC=C6F
InChI=1SC27H19FN4O4c2820421317(20)1333188515(6918)2319(1229)26(30)362724(23)25(313227)167102122(1116)35143421h11123H131430H2(H3132)
MFCD03035396
N#CC1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccccc1F)c(n(nH)2)c1ccc2c(c1)OCO2
ZINC000008553530
ZINC000008553531
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