Vitas-M small molecule compound
1-(4-bromophenyl)-N-(3-chlorophenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK687475
SMILES COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)c1ccc(cc1)Br
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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 C30H25BrClN3O2 MW 574.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25BrClN3O2/c1-37-24-14-10-19(11-15-24)26-18-35-28(29(36)33-23-6-4-5-22(32)17-23)27(20-8-12-21(31)13-9-20)25-7-2-3-16-34(26)30(25)35/h4-6,8-15,17-18H,2-3,7,16H2,1H3,(H,33,36)InChIKey
MGMIFXJKOCSQFO-UHFFFAOYSA-NSynonyms
1(4bromophenyl)N(3chlorophenyl)4(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
COC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)Br)C(=O)NC6=CC(=CC=C6)Cl
InChI=1SC30H25BrClN3O2c13724141019(111524)26183528(29(36)332364522(32)1723)27(2081221(31)13920)257231634(26)30(25)35h468151718H23716H21H3(H3336)
MFCD03287508
ZINC000002591369
ZINC2591369
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