Vitas-M small molecule compound

1-(4-bromophenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene

Catalog ID
STK830486
SMILES COc1ccc(cc1)c1cn2c3c1CCCCn3c(n2)c1ccc(cc1)Br

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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 C22H20BrN3O MW 422.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O/c1-27-18-11-7-15(8-12-18)20-14-26-22-19(20)4-2-3-13-25(22)21(24-26)16-5-9-17(23)10-6-16/h5-12,14H,2-4,13H2,1H3
InChIKey
MIWQVTLSYWHJOA-UHFFFAOYSA-N
Synonyms
325850-40-6
1(4bromophenyl)4(4methoxyphenyl)5678tetrahydro22a8atriazacyclopenta(cd)azulene
325850406
4(4bromophenyl)1(4methoxyphenyl)5678tetrahydro2a34atriazacyclopenta(cd)azulene
COC1=CC=C(C=C1)C2=CN3C4=C2CCCCN4C(=N3)C5=CC=C(C=C5)Br
InChI=1SC22H20BrN3Oc1271811715(81218)2014262219(20)4231325(22)21(2426)165917(23)10616h51214H2413H21H3
MFCD00729413
ZINC000000623189
ZINC00623189
ZINC623189

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Available files

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