Vitas-M small molecule compound
(5-chloro-2-methoxyphenyl){4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}methanone
Catalog ID
STL411736
SMILES COc1ccc(cc1C(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)[N+](=O)[O-])Cl
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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 C21H23ClN4O4 MW 430.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O4/c1-30-20-7-2-14(22)12-17(20)21(27)25-10-8-24(9-11-25)16-5-6-19(26(28)29)18(13-16)23-15-3-4-15/h2,5-7,12-13,15,23H,3-4,8-11H2,1H3InChIKey
ZXVRVYZZGLLPHD-UHFFFAOYSA-NSynonyms
(5chloro2methoxyphenyl)(4(3(cyclopropylamino)4nitrophenyl)piperazin1yl)methanone
COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NC4CC4
COc1ccc(cc1C(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O))Cl
InChI=1SC21H23ClN4O4c130207214(22)1217(20)21(27)2510824(91125)165619(26(28)29)18(1316)23153415h25712131523H34811H21H3
MFCD06633948
ZINC000016226769
ZINC16226769
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