Vitas-M small molecule compound
4-(4-ethoxyphenyl)-N-(2-methoxyphenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK573857
SMILES CCOc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1OC)c1ccc(cc1)OC
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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 C33H33N3O4 MW 535.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O4/c1-4-40-25-18-12-22(13-19-25)28-21-36-31(32(37)34-27-10-5-6-11-29(27)39-3)30(23-14-16-24(38-2)17-15-23)26-9-7-8-20-35(28)33(26)36/h5-6,10-19,21H,4,7-9,20H2,1-3H3,(H,34,37)InChIKey
RYFYWIMENBEAGN-UHFFFAOYSA-NSynonyms
896168-74-44(4ethoxyphenyl)N(2methoxyphenyl)1(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896168744
CCOC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)OC)C(=O)NC6=CC=CC=C6OC
InChI=1SC33H33N3O4c144025181222(131925)28213631(32(37)342710561129(27)393)30(23141624(382)171523)269782035(28)33(26)36h56101921H47920H213H3(H3437)
MFCD06609554
ZINC000097956287
ZINC97956287
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