Vitas-M small molecule compound
1-benzyl-4-(3,4-dichlorophenyl)-3,7,7-trimethyl-4,6,7,8-tetrahydrochromeno[2,3-c]pyrazol-5(1H)-one
Catalog ID
STK334129
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(c(c1)Cl)Cl)c1c(O2)n(nc1C)Cc1ccccc1
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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 C26H24Cl2N2O2 MW 467.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24Cl2N2O2/c1-15-22-23(17-9-10-18(27)19(28)11-17)24-20(31)12-26(2,3)13-21(24)32-25(22)30(29-15)14-16-7-5-4-6-8-16/h4-11,23H,12-14H2,1-3H3InChIKey
PMANJMSGQZFXEO-UHFFFAOYSA-NSynonyms
1benzyl4(34dichlorophenyl)377trimethyl4678tetrahydrochromeno(23c)pyrazol5(1H)one
1benzyl4(34dichlorophenyl)377trimethyl68dihydro4Hchromeno(23c)pyrazol5one
CC1=NN(C2=C1C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)Cl)Cl)CC5=CC=CC=C5
InChI=1SC26H24Cl2N2O2c1152223(1791018(27)19(28)1117)2420(31)1226(23)1321(24)3225(22)30(2915)14167546816h41123H1214H213H3
MFCD09963478
ZINC000018196997
ZINC000018196998
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