Vitas-M small molecule compound
{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}[5-(2-methylpropyl)furan-2-yl]methanone
Catalog ID
STK737203
SMILES CC(Cc1ccc(o1)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[N+](=O)[O-])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 C24H29N5O4 MW 451.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O4/c1-16(2)13-20-6-8-23(33-20)24(30)27-11-9-26(10-12-27)19-5-7-21(29(31)32)22(15-19)28-18(4)14-17(3)25-28/h5-8,14-16H,9-13H2,1-4H3InChIKey
HFKJSFIRRMPOAA-UHFFFAOYSA-NSynonyms
(4(3(35dimethyl1Hpyrazol1yl)4nitrophenyl)piperazin1yl)(5(2methylpropyl)furan2yl)methanone
(4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(5(2METHYLPROPYL)FURAN2YL)METHANONE
CC(Cc1ccc(o1)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O))C
CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=C(O4)CC(C)C)(N+)(=O)(O))C
InChI=1SC24H29N5O4c116(2)13206823(3320)24(30)2711926(101227)195721(29(31)32)22(1519)2818(4)1417(3)2528h581416H913H214H3
MFCD05860209
ZINC000012446083
ZINC12446083
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