Vitas-M small molecule compound
3-(4-methylphenyl)-5-(2-methylpropyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 3-methylbutanoate
Catalog ID
STL349360
SMILES CC(CC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CC(C)C)cccc3)c1ccc(cc1)C)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 C28H30N4O2 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O2/c1-17(2)14-24-30-27-26(28-29-21-8-6-7-9-22(21)32(24)28)23(34-25(33)15-18(3)4)16-31(27)20-12-10-19(5)11-13-20/h6-13,16-18H,14-15H2,1-5H3InChIKey
LNSNWDCBGSEORR-UHFFFAOYSA-NSynonyms
877804-76-73(4methylphenyl)5(2methylpropyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl3methylbutanoate
5isobutyl3(ptolyl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1yl3methylbutanoate
877804767
CC1=CC=C(C=C1)N2C=C(C3=C2N=C(N4C3=NC5=CC=CC=C54)CC(C)C)OC(=O)CC(C)C
InChI=1SC28H30N4O2c117(2)1424302726(282921867922(21)32(24)28)23(3425(33)1518(3)4)1631(27)20121019(5)111320h6131618H1415H215H3
MFCD05704763
ZINC000009293600
ZINC09293600
ZINC9293600
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