Vitas-M small molecule compound
1-[4-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]propan-1-one
Catalog ID
STL000422
SMILES CCC(=O)c1c(c2ccc(cc2)OC)c2c3n1cc(n3CCCC2)c1ccc(c(c1)Cl)Cl
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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 C26H24Cl2N2O2 MW 467.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24Cl2N2O2/c1-3-23(31)25-24(16-7-10-18(32-2)11-8-16)19-6-4-5-13-29-22(15-30(25)26(19)29)17-9-12-20(27)21(28)14-17/h7-12,14-15H,3-6,13H2,1-2H3InChIKey
AIXOQINRXLGZPT-UHFFFAOYSA-NSynonyms
845805-73-41(4(34dichlorophenyl)1(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)propan1one
845805734
CCC(=O)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC(=C(C=C4)Cl)Cl)C5=CC=C(C=C5)OC
InChI=1SC26H24Cl2N2O2c1323(31)2524(1671018(322)11816)19645132922(1530(25)26(19)29)1791220(27)21(28)1417h7121415H3613H212H3
MFCD04170761
ZINC000002418343
ZINC02418343
ZINC2418343
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