Vitas-M small molecule compound
3,3-dimethyl-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL070024
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1cccc(c1)[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 C21H21N3O3 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3/c1-21(2)11-17-19(18(25)12-21)20(13-6-5-7-14(10-13)24(26)27)23-16-9-4-3-8-15(16)22-17/h3-10,20,22-23H,11-12H2,1-2H3InChIKey
UDTSYRNNMDSREV-UHFFFAOYSA-NSynonyms
145628-71-3145628713
33dimethyl11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33DIMETHYL11(3NITROPHENYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
99dimethyl6(3nitrophenyl)681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)C1)C
InChI=1SC21H21N3O3c121(2)111719(18(25)1221)20(1365714(1013)24(26)27)2316943815(16)2217h310202223H1112H212H3
MFCD00731284
O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1cccc(c1)(N+)(=O)(O)
ZINC000000753171
ZINC000000753172
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