Vitas-M small molecule compound
4-(4-bromophenyl)-N-(3-chlorophenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide
Catalog ID
STK770856
SMILES Brc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)Cl)nc3c1ccccc1
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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 C28H22BrClN4O MW 545.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22BrClN4O/c29-20-14-12-18(13-15-20)24-23-11-4-5-16-33-26(19-7-2-1-3-8-19)32-34(28(23)33)25(24)27(35)31-22-10-6-9-21(30)17-22/h1-3,6-10,12-15,17H,4-5,11,16H2,(H,31,35)InChIKey
VKPLYXBWNBPQLJ-UHFFFAOYSA-NSynonyms
540773-96-41(4bromophenyl)N(3chlorophenyl)4phenyl5678tetrahydro2a34atriazacyclopenta(cd)azulene2carboxamide
4(4bromophenyl)N(3chlorophenyl)1phenyl5678tetrahydro22a8atriazacyclopenta(cd)azulene3carboxamide
540773964
C1CCN2C3=C(C1)C(=C(N3N=C2C4=CC=CC=C4)C(=O)NC5=CC(=CC=C5)Cl)C6=CC=C(C=C6)Br
InChI=1SC28H22BrClN4Oc2920141218(131520)24231145163326(197213819)3234(28(23)33)25(24)27(35)3122106921(30)1722h13610121517H451116H2(H3135)
MFCD03460634
ZINC000002247601
ZINC2247601
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