Vitas-M small molecule compound

(3-chloro-4-methylphenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STL420152
SMILES O=C(c1ccc(c(c1)Cl)C)N1CCN(CC1)c1ccc(cc1)[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 C18H18ClN3O3 MW 359.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O3/c1-13-2-3-14(12-17(13)19)18(23)21-10-8-20(9-11-21)15-4-6-16(7-5-15)22(24)25/h2-7,12H,8-11H2,1H3
InChIKey
PNECWWUOUHGWQG-UHFFFAOYSA-N
Synonyms
431996-53-1
(3chloro4methylphenyl)(4(4nitrophenyl)piperazin1yl)methanone
431996531
CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O))Cl
FILASTATIN
InChI=1SC18H18ClN3O3c1132314(1217(13)19)18(23)2110820(91121)154616(7515)22(24)25h2712H811H21H3
MFCD03058358
O=C(c1ccc(c(c1)Cl)C)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000004758640
ZINC04758640
ZINC4758640

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Available files

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