Vitas-M small molecule compound
(4-methylphenyl)(4-{4-nitro-3-[(4-phenylbutan-2-yl)amino]phenyl}piperazin-1-yl)methanone
Catalog ID
STK016407
SMILES CC(Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccc(cc1)C)CCc1ccccc1
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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 C28H32N4O3 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O3/c1-21-8-12-24(13-9-21)28(33)31-18-16-30(17-19-31)25-14-15-27(32(34)35)26(20-25)29-22(2)10-11-23-6-4-3-5-7-23/h3-9,12-15,20,22,29H,10-11,16-19H2,1-2H3InChIKey
JANVPIHSYYWVDF-UHFFFAOYSA-NSynonyms
(4(4nitro3((4phenylbutan2yl)amino)phenyl)piperazin1yl)(ptolyl)methanone
(4METHYLPHENYL)(4(4NITRO3((4PHENYLBUTAN2YL)AMINO)PHENYL)PIPERAZIN1YL)METHANONE
(4METHYLPHENYL)(4(4NITRO3(4PHENYLBUTAN2YLAMINO)PHENYL)PIPERAZIN1YL)METHANONE
CC(Nc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccc(cc1)C)CCc1ccccc1
CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NC(C)CCC4=CC=CC=C4
InChI=1SC28H32N4O3c12181224(13921)28(33)31181630(171931)25141527(32(34)35)26(2025)2922(2)1011236435723h391215202229H10111619H212H3
MFCD02222238
STK016407
ZINC000008984593
ZINC000008984594
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