Vitas-M small molecule compound
N-[(3Z)-8-methyl-1-propyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-nitrobenzamide
Catalog ID
STL042834
SMILES CCCn1[nH]/c(=N\C(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1c(C)cccc1c2
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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 C21H19N5O3 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3/c1-3-11-25-20-17(12-15-6-4-5-13(2)18(15)22-20)19(24-25)23-21(27)14-7-9-16(10-8-14)26(28)29/h4-10,12H,3,11H2,1-2H3,(H,23,24,27)InChIKey
GIFWMSYOJOLJMI-UHFFFAOYSA-NSynonyms
714925-31-2714925312
CCCn1(nH)c(=NC(=O)c2ccc(cc2)(N+)(=O)(O))c2c1nc1c(C)cccc1c2
CCCN1C2=C(C=C3C=CC=C(C3=N2)C)C(=N1)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H19N5O3c1311252017(121564513(2)18(15)2220)19(2425)2321(27)147916(10814)26(28)29h41012H311H212H3(H232427)
MFCD05734095
N((3Z)8methyl1propyl12dihydro3Hpyrazolo(34b)quinolin3ylidene)4nitrobenzamide
N(8METHYL1PROPYLPYRAZOLO(34B)QUINOLIN3YL)4NITROBENZAMIDE
ZINC000005478439
ZINC05478439
ZINC5478439
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