Vitas-M small molecule compound
3-(4-chlorophenyl)-11-(4-methyl-3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK077648
SMILES Clc1ccc(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 C26H22ClN3O3 MW 459.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O3/c1-15-6-7-17(13-23(15)30(32)33)26-25-22(28-20-4-2-3-5-21(20)29-26)12-18(14-24(25)31)16-8-10-19(27)11-9-16/h2-11,13,18,26,28-29H,12,14H2,1H3InChIKey
ZIPJUSUJBLFLKU-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)11(4methyl3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4CHLOROPHENYL)11(4METHYL3NITROPHENYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
9(4chlorophenyl)6(4methyl3nitrophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC5=CC=CC=C5N2)(N+)(=O)(O)
Clc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC26H22ClN3O3c1156717(1323(15)30(32)33)262522(2820423521(20)2926)1218(1424(25)31)1681019(27)11916h2111318262829H1214H21H3
MFCD01824465
STK077648
ZINC000000861526
ZINC000000861529
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