Vitas-M small molecule compound
11-[4-(5-fluoro-2-methoxybenzyl)piperazin-1-yl]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile
Catalog ID
STK953413
SMILES COc1ccc(cc1CN1CCN(CC1)c1c2CCCCc2c(c2n1c1ccccc1n2)C#N)F
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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 C28H28FN5O MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28FN5O/c1-35-26-11-10-20(29)16-19(26)18-32-12-14-33(15-13-32)28-22-7-3-2-6-21(22)23(17-30)27-31-24-8-4-5-9-25(24)34(27)28/h4-5,8-11,16H,2-3,6-7,12-15,18H2,1H3InChIKey
PCQVBIKLHVIPAF-UHFFFAOYSA-NSynonyms
683795-97-311(4((5fluoro2methoxyphenyl)methyl)piperazin1yl)78910tetrahydrobenzimidazolo(12b)isoquinoline6carbonitrile
11(4(5fluoro2methoxybenzyl)piperazin1yl)78910tetrahydrobenzimidazo(12b)isoquinoline6carbonitrile
11(4(5fluoro2methoxybenzyl)piperazin1yl)78910tetrahydrobenzo(45)imidazo(12b)isoquinoline6carbonitrile
683795973
COC1=C(C=C(C=C1)F)CN2CCN(CC2)C3=C4CCCCC4=C(C5=NC6=CC=CC=C6N35)C#N
InChI=1SC28H28FN5Oc13526111020(29)1619(26)1832121433(151332)2822732621(22)23(1730)273124845925(24)34(27)28h4581116H2367121518H21H3
MFCD03932884
ZINC000020358400
ZINC20358400
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