Vitas-M small molecule compound
1-benzyl-3-methyl-4-[4-(methylsulfanyl)phenyl]-4,6,7,8-tetrahydrochromeno[2,3-c]pyrazol-5(1H)-one
Catalog ID
STK333975
SMILES CSc1ccc(cc1)C1C2=C(CCCC2=O)Oc2c1c(C)nn2Cc1ccccc1
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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 C25H24N2O2S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O2S/c1-16-22-23(18-11-13-19(30-2)14-12-18)24-20(28)9-6-10-21(24)29-25(22)27(26-16)15-17-7-4-3-5-8-17/h3-5,7-8,11-14,23H,6,9-10,15H2,1-2H3InChIKey
PNPILMOABHNGGE-UHFFFAOYSA-NSynonyms
1benzyl3methyl4(4(methylsulfanyl)phenyl)4678tetrahydrochromeno(23c)pyrazol5(1H)one
1benzyl3methyl4(4methylsulfanylphenyl)4678tetrahydrochromeno(23c)pyrazol5one
CC1=NN(C2=C1C(C3=C(O2)CCCC3=O)C4=CC=C(C=C4)SC)CC5=CC=CC=C5
InChI=1SC25H24N2O2Sc1162223(18111319(302)141218)2420(28)961021(24)2925(22)27(2616)15177435817h3578111423H691015H212H3
MFCD09963343
ZINC000018196576
ZINC000018196578
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