Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(propan-2-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 2-methylpropanoate
Catalog ID
STK716168
SMILES O=C(C(C)C)Oc1cn(c2c1c1nc3c(n1c(n2)C(C)C)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 C27H26N4O4 MW 470.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4/c1-15(2)24-29-25-23(26-28-18-7-5-6-8-19(18)31(24)26)22(35-27(32)16(3)4)14-30(25)17-9-10-20-21(13-17)34-12-11-33-20/h5-10,13-16H,11-12H2,1-4H3InChIKey
USYJGBYSMAIXLY-UHFFFAOYSA-NSynonyms
885203-36-13(23dihydro14benzodioxin6yl)5(propan2yl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl2methylpropanoate
3(23dihydrobenzo(b)(14)dioxin6yl)5isopropyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylisobutyrate
885203361
CC(C)C1=NC2=C(C(=CN2C3=CC4=C(C=C3)OCCO4)OC(=O)C(C)C)C5=NC6=CC=CC=C6N51
InChI=1SC27H26N4O4c115(2)24292523(262818756819(18)31(24)26)22(3527(32)16(3)4)1430(25)179102021(1317)3412113320h5101316H1112H214H3
MFCD06598991
ZINC000009243439
ZINC09243439
ZINC9243439
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