Vitas-M small molecule compound
{4-[3-(4-benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-chlorophenyl)methanone
Catalog ID
STK205916
SMILES Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)Cc1ccccc1)[N+](=O)[O-]
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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 C28H30ClN5O3 MW 520.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30ClN5O3/c29-24-8-6-23(7-9-24)28(35)33-18-16-31(17-19-33)25-10-11-26(34(36)37)27(20-25)32-14-12-30(13-15-32)21-22-4-2-1-3-5-22/h1-11,20H,12-19,21H2InChIKey
PMDXLGCDVOUFFO-UHFFFAOYSA-NSynonyms
(4(3(4BENZYLPIPERAZIN1YL)4NITROPHENYL)PIPERAZIN1YL)(4CHLOROPHENYL)METHANONE
C1CN(CCN1CC2=CC=CC=C2)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)Cl)(N+)(=O)(O)
Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC28H30ClN5O3c29248623(7924)28(35)33181631(171933)25101126(34(36)37)27(2025)32141230(131532)21224213522h11120H121921H2
MFCD06005985
ZINC000055552707
ZINC55552707
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