Vitas-M small molecule compound
5-butyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl pentanoate
Catalog ID
STK991236
SMILES CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)c1ccc2c(c1)OCCO2
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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 C29H30N4O4 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O4/c1-3-5-11-25-31-28-27(29-30-20-9-7-8-10-21(20)33(25)29)24(37-26(34)12-6-4-2)18-32(28)19-13-14-22-23(17-19)36-16-15-35-22/h7-10,13-14,17-18H,3-6,11-12,15-16H2,1-2H3InChIKey
XRQDIVAPRPCIAV-UHFFFAOYSA-NSynonyms
885203-42-95butyl3(23dihydro14benzodioxin6yl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylpentanoate
5butyl3(23dihydrobenzo(b)(14)dioxin6yl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylpentanoate
885203429
CCCCC1=NC2=C(C(=CN2C3=CC4=C(C=C3)OCCO4)OC(=O)CCCC)C5=NC6=CC=CC=C6N15
InChI=1SC29H30N4O4c1351125312827(2930209781021(20)33(25)29)24(3726(34)12642)1832(28)1913142223(1719)3616153522h71013141718H3611121516H212H3
MFCD06591574
ZINC000009293033
ZINC09293033
ZINC9293033
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