Vitas-M small molecule compound
N-{3-chloro-4-[4-(2-chlorobenzyl)piperazin-1-yl]phenyl}-4-ethoxy-3-nitrobenzamide
Catalog ID
STL119660
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccc(c(c1)Cl)N1CCN(CC1)Cc1ccccc1Cl
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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 C26H26Cl2N4O4 MW 529.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26Cl2N4O4/c1-2-36-25-10-7-18(15-24(25)32(34)35)26(33)29-20-8-9-23(22(28)16-20)31-13-11-30(12-14-31)17-19-5-3-4-6-21(19)27/h3-10,15-16H,2,11-14,17H2,1H3,(H,29,33)InChIKey
BMKCEHQXEGQFEU-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4Cl)Cl)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)Nc1ccc(c(c1)Cl)N1CCN(CC1)Cc1ccccc1Cl
InChI=1SC26H26Cl2N4O4c12362510718(1524(25)32(34)35)26(33)29208923(22(28)1620)31131130(121431)1719534621(19)27h3101516H2111417H21H3(H2933)
MFCD05808205
N(3CHLORO4(4((2CHLOROPHENYL)METHYL)PIPERAZIN1YL)PHENYL)4ETHOXY3NITROBENZAMIDE
N(3CHLORO4(4((2CHLOROPHENYL)METHYL)PIPERAZINYL)PHENYL)(4ETHOXY3NITROPHENYL)CARBOXAMIDE
N(3chloro4(4(2chlorobenzyl)piperazin1yl)phenyl)4ethoxy3nitrobenzamide
ZINC000100142912
ZINC100142912
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