Vitas-M small molecule compound

methyl 4-[1-(acetyloxy)-5-methyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-3-yl]benzoate

Catalog ID
STK991163
SMILES COC(=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 C23H18N4O4 MW 414.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O4/c1-13-24-21-20(22-25-17-6-4-5-7-18(17)27(13)22)19(31-14(2)28)12-26(21)16-10-8-15(9-11-16)23(29)30-3/h4-12H,1-3H3
InChIKey
SHVRHYYJDOZRLK-UHFFFAOYSA-N
Synonyms
850237-67-1
850237671
CC1=NC2=C(C(=CN2C3=CC=C(C=C3)C(=O)OC)OC(=O)C)C4=NC5=CC=CC=C5N14
InChI=1SC23H18N4O4c113242120(222517645718(17)27(13)22)19(3114(2)28)1226(21)1610815(91116)23(29)303h412H13H3
methyl4(1(acetyloxy)5methyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol3yl)benzoate
methyl4(1acetoxy5methyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin3yl)benzoate
MFCD05691676
ZINC000195817328
ZINC13807340
ZINC195817328

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Available files

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