Vitas-M small molecule compound
2-bromo-N-[(3E)-1-butyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide
Catalog ID
STL050662
SMILES CCCCn1[nH]/c(=N/C(=O)c2ccccc2Br)/c2c1nc1c(c2)cccc1C
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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 C22H21BrN4O MW 437.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN4O/c1-3-4-12-27-21-17(13-15-9-7-8-14(2)19(15)24-21)20(26-27)25-22(28)16-10-5-6-11-18(16)23/h5-11,13H,3-4,12H2,1-2H3,(H,25,26,28)InChIKey
IFKGUZKSJWSJPS-UHFFFAOYSA-NSynonyms
714247-62-82bromoN((3E)1butyl8methyl12dihydro3Hpyrazolo(34b)quinolin3ylidene)benzamide
2BROMON(1BUTYL8METHYL1HPYRAZOLO(34B)QUINOLIN3YL)BENZAMIDE
2BROMON(1BUTYL8METHYLPYRAZOLO(34B)QUINOLIN3YL)BENZAMIDE
714247628
CCCCn1(nH)c(=NC(=O)c2ccccc2Br)c2c1nc1c(c2)cccc1C
CCCCN1C2=C(C=C3C=CC=C(C3=N2)C)C(=N1)NC(=O)C4=CC=CC=C4Br
InChI=1SC22H21BrN4Oc13412272117(131597814(2)19(15)2421)20(2627)2522(28)1610561118(16)23h51113H3412H212H3(H252628)
MFCD05731409
ZINC000009350650
ZINC09350650
ZINC9350650
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