Vitas-M small molecule compound
(4-methylphenyl)[4-(4-nitro-3-{[4-(propan-2-yl)benzyl]amino}phenyl)piperazin-1-yl]methanone
Catalog ID
STK147689
SMILES Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccc(cc1)C(C)C)[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 C28H32N4O3 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O3/c1-20(2)23-10-6-22(7-11-23)19-29-26-18-25(12-13-27(26)32(34)35)30-14-16-31(17-15-30)28(33)24-8-4-21(3)5-9-24/h4-13,18,20,29H,14-17,19H2,1-3H3InChIKey
PCXRVRYTQRQHPW-UHFFFAOYSA-NSynonyms
(4METHYLPHENYL)(4(4NITRO3((4(PROPAN2YL)BENZYL)AMINO)PHENYL)PIPERAZIN1YL)METHANONE
(4METHYLPHENYL)(4(4NITRO3((4PROPAN2YLPHENYL)METHYLAMINO)PHENYL)PIPERAZIN1YL)METHANONE
4(3(((4(METHYLETHYL)PHENYL)METHYL)AMINO)4NITROPHENYL)PIPERAZINYL4METHYLPHENYLKETONE
CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=C(C=C4)C(C)C
Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccc(cc1)C(C)C)(N+)(=O)(O)
InChI=1SC28H32N4O3c120(2)2310622(71123)1929261825(121327(26)32(34)35)30141631(171530)28(33)248421(3)5924h413182029H141719H213H3
MFCD02227888
ZINC000006245031
ZINC06245031
ZINC6245031
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