Vitas-M small molecule compound

3-octyl-5-(propan-2-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 2-methylpropanoate

Catalog ID
STK716103
SMILES CCCCCCCCn1cc(c2c1nc(C(C)C)n1c2nc2c1cccc2)OC(=O)C(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 C27H36N4O2 MW 448.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N4O2/c1-6-7-8-9-10-13-16-30-17-22(33-27(32)19(4)5)23-25(30)29-24(18(2)3)31-21-15-12-11-14-20(21)28-26(23)31/h11-12,14-15,17-19H,6-10,13,16H2,1-5H3
InChIKey
YJIORNIBJRKATO-UHFFFAOYSA-N
Synonyms
885198-12-9
3octyl5(propan2yl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl2methylpropanoate
5isopropyl3octyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylisobutyrate
885198129
CCCCCCCCN1C=C(C2=C1N=C(N3C2=NC4=CC=CC=C43)C(C)C)OC(=O)C(C)C
InChI=1SC27H36N4O2c16789101316301722(3327(32)19(4)5)2325(30)2924(18(2)3)31211512111420(21)2826(23)31h111214151719H6101316H215H3
MFCD06601012
ZINC000002227104
ZINC2227104

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Available files

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