Vitas-M small molecule compound
3-(4-{[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-7-methylfuro[2,3-c]pyridin-4-yl]methyl}piperazin-1-yl)propanenitrile
Catalog ID
STL309366
SMILES N#CCCN1CCN(CC1)Cc1cnc(c2c1cc(o2)C(=O)c1ccc2c(c1)OCCO2)C
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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 C25H26N4O4 MW 446.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4/c1-17-25-20(19(15-27-17)16-29-9-7-28(8-10-29)6-2-5-26)14-23(33-25)24(30)18-3-4-21-22(13-18)32-12-11-31-21/h3-4,13-15H,2,6-12,16H2,1H3InChIKey
DHBHNXPIUHSOCD-UHFFFAOYSA-NSynonyms
3(4((2(23dihydro14benzodioxin6ylcarbonyl)7methylfuro(23c)pyridin4yl)methyl)piperazin1yl)propanenitrile
3(4((2(23dihydro14benzodioxine6carbonyl)7methylfuro(23c)pyridin4yl)methyl)piperazin1yl)propanenitrile
3(4((2(23dihydrobenzo(b)(14)dioxine6carbonyl)7methylfuro(23c)pyridin4yl)methyl)piperazin1yl)propanenitriledihydrochloride
CC1=NC=C(C2=C1OC(=C2)C(=O)C3=CC4=C(C=C3)OCCO4)CN5CCN(CC5)CCC#N
InChI=1SC25H26N4O4c1172520(19(152717)16299728(81029)62526)1423(3325)24(30)18342122(1318)3212113121h341315H261216H21H3
MFCD28028887
N#CCCN1CCN(CC1)Cc1cnc(c2c1cc(o2)C(=O)c1ccc2c(c1)OCCO2)CClCl
ZINC000095472520
ZINC95472520
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