Vitas-M small molecule compound

N-[(3Z)-1-butyl-6-methoxy-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-3-nitrobenzamide

Catalog ID
STK570109
SMILES CCCCn1[nH]/c(=N\C(=O)c2cccc(c2)[N+](=O)[O-])/c2c1nc1ccc(cc1c2)OC

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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 C22H21N5O4 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4/c1-3-4-10-26-21-18(13-15-12-17(31-2)8-9-19(15)23-21)20(25-26)24-22(28)14-6-5-7-16(11-14)27(29)30/h5-9,11-13H,3-4,10H2,1-2H3,(H,24,25,28)
InChIKey
BSYMQVRNQRKKGN-UHFFFAOYSA-N
Synonyms
713093-65-3
713093653
CCCCn1(nH)c(=NC(=O)c2cccc(c2)(N+)(=O)(O))c2c1nc1ccc(cc1c2)OC
CCCCN1C2=C(C=C3C=C(C=CC3=N2)OC)C(=N1)NC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H21N5O4c13410262118(13151217(312)8919(15)2321)20(2526)2422(28)1465716(1114)27(29)30h591113H3410H212H3(H242528)
MFCD05725648
N((3Z)1butyl6methoxy12dihydro3Hpyrazolo(34b)quinolin3ylidene)3nitrobenzamide
N(1BUTYL6METHOXY1HPYRAZOLO(34B)QUINOLIN3YL)3NITROBENZAMIDE
N(1BUTYL6METHOXYPYRAZOLO(34B)QUINOLIN3YL)3NITROBENZAMIDE
ZINC000002194182
ZINC02194182
ZINC2194182

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Available files

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