Vitas-M small molecule compound
1-{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}-2-(4-tert-butylphenoxy)ethanone
Catalog ID
STK052001
SMILES O=C(N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)[N+](=O)[O-])COc1ccc(cc1)C(C)(C)C
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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 C29H34N4O4 MW 502.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O4/c1-29(2,3)23-9-12-25(13-10-23)37-21-28(34)32-17-15-31(16-18-32)24-11-14-27(33(35)36)26(19-24)30-20-22-7-5-4-6-8-22/h4-14,19,30H,15-18,20-21H2,1-3H3InChIKey
WCXHGUWJHKKEBM-UHFFFAOYSA-NSynonyms
1(4(3(benzylamino)4nitrophenyl)piperazin1yl)2(4(tertbutyl)phenoxy)ethanone
1(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)2(4TERTBUTYLPHENOXY)ETHANONE
2(4(TERTBUTYL)PHENOXY)1(4(4NITRO3(BENZYLAMINO)PHENYL)PIPERAZINYL)ETHAN1ONE
CC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=CC=C4
InChI=1SC29H34N4O4c129(23)2391225(131023)372128(34)32171531(161832)24111427(33(35)36)26(1924)3020227546822h4141930H15182021H213H3
MFCD02627830
O=C(N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)(N+)(=O)(O))COc1ccc(cc1)C(C)(C)C
STK052001
ZINC000008816629
ZINC08816629
ZINC8816629
Check stock
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Check stock on Vitas-MAvailable files
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