Vitas-M small molecule compound
1-[1-(4-chlorophenyl)-4-(3,4-dichlorophenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]butan-1-one
Catalog ID
STL002688
SMILES CCCC(=O)c1c(c2ccc(cc2)Cl)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 C26H23Cl3N2O MW 485.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl3N2O/c1-2-5-23(32)25-24(16-7-10-18(27)11-8-16)19-6-3-4-13-30-22(15-31(25)26(19)30)17-9-12-20(28)21(29)14-17/h7-12,14-15H,2-6,13H2,1H3InChIKey
ADKHVSJJYQLWTP-UHFFFAOYSA-NSynonyms
846579-26-81(1(4chlorophenyl)4(34dichlorophenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)butan1one
846579268
CCCC(=O)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC(=C(C=C4)Cl)Cl)C5=CC=C(C=C5)Cl
InChI=1SC26H23Cl3N2Oc12523(32)2524(1671018(27)11816)19634133022(1531(25)26(19)30)1791220(28)21(29)1417h7121415H2613H21H3
MFCD04174981
ZINC000002448963
ZINC02448963
ZINC2448963
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