Vitas-M small molecule compound
propyl 4-[1-(acetyloxy)-5-methyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-3-yl]benzoate
Catalog ID
STK991165
SMILES CCCOC(=O)c1ccc(cc1)n1cc(c2c1nc(C)n1c2nc2c1cccc2)OC(=O)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 C25H22N4O4 MW 442.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O4/c1-4-13-32-25(31)17-9-11-18(12-10-17)28-14-21(33-16(3)30)22-23(28)26-15(2)29-20-8-6-5-7-19(20)27-24(22)29/h5-12,14H,4,13H2,1-3H3InChIKey
HIXRKGNALCQHRV-UHFFFAOYSA-NSynonyms
877801-23-5877801235
CCCOC(=O)C1=CC=C(C=C1)N2C=C(C3=C2N=C(N4C3=NC5=CC=CC=C54)C)OC(=O)C
InChI=1SC25H22N4O4c14133225(31)1791118(121017)281421(3316(3)30)2223(28)2615(2)2920865719(20)2724(22)29h51214H413H213H3
MFCD05704082
propyl4(1(acetyloxy)5methyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol3yl)benzoate
propyl4(1acetoxy5methyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin3yl)benzoate
ZINC000008871224
ZINC08871224
ZINC8871224
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