Vitas-M small molecule compound
4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK598775
SMILES COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1OC)cc3c1ccc(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 C31H28ClN3O3 MW 526.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O3/c1-37-23-16-12-21(13-17-23)28-24-7-5-6-18-34-26(20-10-14-22(32)15-11-20)19-35(31(24)34)29(28)30(36)33-25-8-3-4-9-27(25)38-2/h3-4,8-17,19H,5-7,18H2,1-2H3,(H,33,36)InChIKey
BMVGVHONYDHJNI-UHFFFAOYSA-NSynonyms
877778-19-34(4chlorophenyl)N(2methoxyphenyl)1(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
877778193
COC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)Cl)C(=O)NC6=CC=CC=C6OC
InChI=1SC31H28ClN3O3c13723161221(131723)2824756183426(20101422(32)151120)1935(31(24)34)29(28)30(36)3325834927(25)382h3481719H5718H212H3(H3336)
MFCD05699856
ZINC000009344889
ZINC09344889
ZINC9344889
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