Vitas-M small molecule compound
4-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-1-(4-ethoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STL041674
SMILES CCOc1ccc(cc1)c1c(C(=O)Nc2ccc(c(c2)Cl)Cl)n2c3c1CCCCn3c(c2)c1ccc(cc1)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 C31H26Cl3N3O2 MW 578.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26Cl3N3O2/c1-2-39-23-13-8-20(9-14-23)28-24-5-3-4-16-36-27(19-6-10-21(32)11-7-19)18-37(31(24)36)29(28)30(38)35-22-12-15-25(33)26(34)17-22/h6-15,17-18H,2-5,16H2,1H3,(H,35,38)InChIKey
QXKLMNSJWSXULH-UHFFFAOYSA-NSynonyms
714245-34-84(4chlorophenyl)N(34dichlorophenyl)1(4ethoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
714245348
CCOC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)Cl)C(=O)NC6=CC(=C(C=C6)Cl)Cl
InChI=1SC31H26Cl3N3O2c12392313820(91423)2824534163627(1961021(32)11719)1837(31(24)36)29(28)30(38)3522121525(33)26(34)1722h6151718H2516H21H3(H3538)
MFCD05731006
ZINC000001877062
ZINC01877062
ZINC1877062
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