Vitas-M small molecule compound
N-[(3Z)-1-butyl-6-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-nitrobenzamide
Catalog ID
STL042030
SMILES CCCCn1[nH]/c(=N\C(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1ccc(cc1c2)C
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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 C22H21N5O3 MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O3/c1-3-4-11-26-21-18(13-16-12-14(2)5-10-19(16)23-21)20(25-26)24-22(28)15-6-8-17(9-7-15)27(29)30/h5-10,12-13H,3-4,11H2,1-2H3,(H,24,25,28)InChIKey
BWKNVBOHAZGMDS-UHFFFAOYSA-NSynonyms
714246-12-5714246125
CCCCn1(nH)c(=NC(=O)c2ccc(cc2)(N+)(=O)(O))c2c1nc1ccc(cc1c2)C
CCCCN1C2=C(C=C3C=C(C=CC3=N2)C)C(=N1)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC22H21N5O3c13411262118(13161214(2)51019(16)2321)20(2526)2422(28)156817(9715)27(29)30h5101213H3411H212H3(H242528)
MFCD05731158
N((3Z)1butyl6methyl12dihydro3Hpyrazolo(34b)quinolin3ylidene)4nitrobenzamide
N(1BUTYL6METHYL1HPYRAZOLO(34B)QUINOLIN3YL)4NITROBENZAMIDE
N(1BUTYL6METHYLPYRAZOLO(34B)QUINOLIN3YL)4NITROBENZAMIDE
ZINC000005518059
ZINC05518059
ZINC5518059
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