Vitas-M small molecule compound
{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}(3,5-dichloro-4-methoxyphenyl)methanone
Catalog ID
STK148657
SMILES COc1c(Cl)cc(cc1Cl)C(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)[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 C21H22Cl2N4O4 MW 465.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N4O4/c1-31-20-16(22)10-13(11-17(20)23)21(28)26-8-6-25(7-9-26)15-4-5-19(27(29)30)18(12-15)24-14-2-3-14/h4-5,10-12,14,24H,2-3,6-9H2,1H3InChIKey
QIWFYCQPKNZUKE-UHFFFAOYSA-NSynonyms
(4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(35DICHLORO4METHOXYPHENYL)METHANONE
1(3(CYCLOPROPYLAMINO)4NITROPHENYL)4(35DICHLORO4METHOXYBENZOYL)PIPERAZINE
COC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NC4CC4)Cl
COc1c(Cl)cc(cc1Cl)C(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O)
InChI=1SC21H22Cl2N4O4c1312016(22)1013(1117(20)23)21(28)268625(7926)154519(27(29)30)18(1215)24142314h4510121424H2369H21H3
MFCD02153057
ZINC000008443041
ZINC08443041
ZINC8443041
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