Vitas-M small molecule compound
4-(2,3-dichlorophenyl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333350
SMILES O=C1CCCC2=C1C(c1cccc(c1Cl)Cl)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 C22H17Cl2N3O2 MW 426.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2N3O2/c23-14-9-4-8-13(20(14)24)17-18-15(10-5-11-16(18)28)25-21-19(17)22(29)27(26-21)12-6-2-1-3-7-12/h1-4,6-9,17,25-26H,5,10-11H2InChIKey
BTSCACKNJHAWSW-UHFFFAOYSA-NSynonyms
4(23dichlorophenyl)2phenyl146789hexahydropyrazolo(34b)quinoline35dione
4(23dichlorophenyl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
C1CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=C(C(=CC=C5)Cl)Cl)C(=O)C1
InChI=1SC22H17Cl2N3O2c231494813(20(14)24)171815(1051116(18)28)252119(17)22(29)27(2621)126213712h1469172526H51011H2
MFCD09963001
O=C1CCCC2=C1C(c1cccc(c1Cl)Cl)c1c(N2)(nH)n(c1=O)c1ccccc1
ZINC000018195706
ZINC000018195708
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