Vitas-M small molecule compound
N-(4-chlorophenyl)-1-(4-methoxyphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STK606295
SMILES COc1ccc(cc1)c1c(C(=S)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(c2)c1ccccc1
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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 C30H26ClN3OS MW 512.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3OS/c1-35-24-16-10-21(11-17-24)27-25-9-5-6-18-33-26(20-7-3-2-4-8-20)19-34(30(25)33)28(27)29(36)32-23-14-12-22(31)13-15-23/h2-4,7-8,10-17,19H,5-6,9,18H2,1H3,(H,32,36)InChIKey
RDAVBGPPHSIMKL-UHFFFAOYSA-NSynonyms
496796-76-0496796760
COC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=CC=C5)C(=S)NC6=CC=C(C=C6)Cl
InChI=1SC30H26ClN3OSc13524161021(111724)2725956183326(207324820)1934(30(25)33)28(27)29(36)3223141222(31)131523h2478101719H56918H21H3(H3236)
MFCD03298879
N(4chlorophenyl)1(4methoxyphenyl)4phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000002304464
ZINC02304464
ZINC2304464
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