Vitas-M small molecule compound
4-(3-methylthiophen-2-yl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333460
SMILES O=C1CCCC2=C1C(c1sccc1C)c1c(N2)[nH]n(c1=O)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 C21H19N3O2S MW 377.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O2S/c1-12-10-11-27-19(12)17-16-14(8-5-9-15(16)25)22-20-18(17)21(26)24(23-20)13-6-3-2-4-7-13/h2-4,6-7,10-11,17,22-23H,5,8-9H2,1H3InChIKey
NZIRFFWKZRMZRI-UHFFFAOYSA-NSynonyms
4(3methylthiophen2yl)2phenyl146789hexahydropyrazolo(34b)quinoline35dione
4(3methylthiophen2yl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CC1=C(SC=C1)C2C3=C(CCCC3=O)NC4=C2C(=O)N(N4)C5=CC=CC=C5
InChI=1SC21H19N3O2Sc11210112719(12)171614(85915(16)25)222018(17)21(26)24(2320)136324713h24671011172223H589H21H3
MFCD09963077
O=C1CCCC2=C1C(c1sccc1C)c1c(N2)(nH)n(c1=O)c1ccccc1
ZINC000012348688
ZINC000012348694
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