Vitas-M small molecule compound
10-acetyl-3,3-dimethyl-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK324682
SMILES O=C1CC(C)(C)CC2=C1C(c1cccc(c1)[N+](=O)[O-])N(C(=O)C)c1c(N2)cccc1
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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 C23H23N3O4 MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O4/c1-14(27)25-19-10-5-4-9-17(19)24-18-12-23(2,3)13-20(28)21(18)22(25)15-7-6-8-16(11-15)26(29)30/h4-11,22,24H,12-13H2,1-3H3InChIKey
HVSAVGXUSWOHLP-UHFFFAOYSA-NSynonyms
312621-60-610acetyl33dimethyl11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312621606
5acetyl99dimethyl6(3nitrophenyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC23H23N3O4c114(27)25191054917(19)24181223(23)1320(28)21(18)22(25)1576816(1115)26(29)30h4112224H1213H213H3
MFCD01210473
O=C1CC(C)(C)CC2=C1C(c1cccc(c1)(N+)(=O)(O))N(C(=O)C)c1c(N2)cccc1
ZINC000000849842
ZINC000000849843
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