Vitas-M small molecule compound
11-(4-methyl-3-nitrophenyl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403502
SMILES Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(c(c1)[N+](=O)[O-])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 C27H25N3O3 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O3/c1-16-7-10-18(11-8-16)20-13-23-26(25(31)15-20)27(29-22-6-4-3-5-21(22)28-23)19-12-9-17(2)24(14-19)30(32)33/h3-12,14,20,27-29H,13,15H2,1-2H3InChIKey
FZWFXQJDLNGVJB-UHFFFAOYSA-NSynonyms
11(4methyl3nitrophenyl)3(4methylphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4methyl3nitrophenyl)9(4methylphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=C(C=C5)C)(N+)(=O)(O))C(=O)C2
Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC27H25N3O3c11671018(11816)20132326(25(31)1520)27(2922643521(22)2823)1912917(2)24(1419)30(32)33h31214202729H1315H212H3
MFCD03489355
ZINC000001437502
ZINC000001437505
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