Vitas-M small molecule compound
(2E)-3-[3-(4-methoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2-[(4-methylpiperazin-1-yl)carbonyl]prop-2-enenitrile
Catalog ID
STK821341
SMILES N#C/C(=C\c1cn(nc1c1ccc(c(c1)[N+](=O)[O-])OC)c1ccccc1)/C(=O)N1CCN(CC1)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 C25H24N6O4 MW 472.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N6O4/c1-28-10-12-29(13-11-28)25(32)19(16-26)14-20-17-30(21-6-4-3-5-7-21)27-24(20)18-8-9-23(35-2)22(15-18)31(33)34/h3-9,14-15,17H,10-13H2,1-2H3/b19-14+InChIKey
MYDQTYOYNTWAFW-XMHGGMMESA-NSynonyms
(2E)3(3(4methoxy3nitrophenyl)1phenyl1Hpyrazol4yl)2((4methylpiperazin1yl)carbonyl)prop2enenitrile
(E)3(3(4methoxy3nitrophenyl)1phenylpyrazol4yl)2(4methylpiperazine1carbonyl)prop2enenitrile
CN1CCN(CC1)C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)(N+)(=O)(O))C4=CC=CC=C4)C#N
InChI=1SC25H24N6O4c128101229(131128)25(32)19(1626)14201730(216435721)2724(20)188923(352)22(1518)31(33)34h39141517H1013H212H3b1914+
MFCD03462713
N#CC(=Cc1cn(nc1c1ccc(c(c1)(N+)(=O)(O))OC)c1ccccc1)C(=O)N1CCN(CC1)C
ZINC000026963871
ZINC26963871
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