Vitas-M small molecule compound
[4-(1H-benzimidazol-2-yl)piperidin-1-yl](3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone
Catalog ID
STL410566
SMILES O=C(c1ccc2c(c1)OCCCO2)N1CCC(CC1)c1nc2c([nH]1)cccc2
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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 C22H23N3O3 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3/c26-22(16-6-7-19-20(14-16)28-13-3-12-27-19)25-10-8-15(9-11-25)21-23-17-4-1-2-5-18(17)24-21/h1-2,4-7,14-15H,3,8-13H2,(H,23,24)InChIKey
YVSXTVKRROLSQL-UHFFFAOYSA-NSynonyms
1326594-95-9(4(1Hbenzimidazol2yl)piperidin1yl)(34dihydro2H15benzodioxepin7yl)methanone
(4(1Hbenzo(d)imidazol2yl)piperidin1yl)(34dihydro2Hbenzo(b)(14)dioxepin7yl)methanone
1326594959
C1COC2=C(C=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4)OC1
InChI=1SC22H23N3O3c2622(16671920(1416)28133122719)2510815(91125)212317412518(17)2421h12471415H3813H2(H2324)
MFCD17875501
O=C(c1ccc2c(c1)OCCCO2)N1CCC(CC1)c1nc2c((nH)1)cccc2
ZINC000029267974
ZINC29267974
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