Vitas-M small molecule compound
3-(4-methoxyphenyl)-11-(4-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK028319
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(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 C26H23N3O4 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O4/c1-33-20-12-8-16(9-13-20)18-14-23-25(24(30)15-18)26(17-6-10-19(11-7-17)29(31)32)28-22-5-3-2-4-21(22)27-23/h2-13,18,26-28H,14-15H2,1H3InChIKey
UNQYSMUMZWEZGU-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)11(4nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4METHOXYPHENYL)11(4NITROPHENYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
9(4methoxyphenyl)6(4nitrophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=C(C=C5)(N+)(=O)(O))C(=O)C2
COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H23N3O4c1332012816(91320)18142325(24(30)1518)26(1761019(11717)29(31)32)2822532421(22)2723h213182628H1415H21H3
MFCD01825176
STK028319
ZINC000000681875
ZINC000000681878
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