Vitas-M small molecule compound
6-{2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxoethyl}-2,3,5-trimethyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STK620559
SMILES O=C(N1CCC(CC1)c1nc2c([nH]1)cccc2)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)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 C28H27N3O4 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O4/c1-15-17(3)34-24-14-25-20(12-19(15)24)16(2)21(28(33)35-25)13-26(32)31-10-8-18(9-11-31)27-29-22-6-4-5-7-23(22)30-27/h4-7,12,14,18H,8-11,13H2,1-3H3,(H,29,30)InChIKey
BWTVFQUBRUMMAF-UHFFFAOYSA-NSynonyms
929856-67-76(2(4(1Hbenzimidazol2yl)piperidin1yl)2oxoethyl)235trimethyl7Hfuro(32g)chromen7one
6(2(4(1Hbenzimidazol2yl)piperidin1yl)2oxoethyl)235trimethylfuro(32g)chromen7one
6(2(4(1Hbenzo(d)imidazol2yl)piperidin1yl)2oxoethyl)235trimethyl7Hfuro(32g)chromen7one
929856677
CC1=C(OC2=C1C=C3C(=C(C(=O)OC3=C2)CC(=O)N4CCC(CC4)C5=NC6=CC=CC=C6N5)C)C
InChI=1SC28H27N3O4c11517(3)3424142520(1219(15)24)16(2)21(28(33)3525)1326(32)3110818(91131)272922645723(22)3027h47121418H81113H213H3(H2930)
MFCD09793256
O=C(N1CCC(CC1)c1nc2c((nH)1)cccc2)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
ZINC000009421351
ZINC09421351
ZINC9421351
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