Vitas-M small molecule compound
1-[4-(4-fluorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]propan-1-one
Catalog ID
STL342986
SMILES CCC(=O)c1c(c2ccc(cc2)C)c2c3n1cc(n3CCCC2)c1ccc(cc1)F
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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 C26H25FN2O MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN2O/c1-3-23(30)25-24(19-9-7-17(2)8-10-19)21-6-4-5-15-28-22(16-29(25)26(21)28)18-11-13-20(27)14-12-18/h7-14,16H,3-6,15H2,1-2H3InChIKey
WSZSLZRCZDQLMH-UHFFFAOYSA-NSynonyms
844824-47-11(4(4fluorophenyl)1(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)propan1one
1(4(4fluorophenyl)1(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)propan1one
844824471
CCC(=O)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC=C(C=C4)F)C5=CC=C(C=C5)C
InChI=1SC26H25FN2Oc1323(30)2524(199717(2)81019)21645152822(1629(25)26(21)28)18111320(27)141218h71416H3615H212H3
MFCD04160801
ZINC000002405910
ZINC02405910
ZINC2405910
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