Vitas-M small molecule compound

10-[(4-fluorophenyl)carbonyl]-3,3-dimethyl-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STL171060
SMILES Fc1ccc(cc1)C(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)(C)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 C28H24FN3O4 MW 485.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FN3O4/c1-28(2)15-22-25(24(33)16-28)26(18-6-5-7-20(14-18)32(35)36)31(23-9-4-3-8-21(23)30-22)27(34)17-10-12-19(29)13-11-17/h3-14,26,30H,15-16H2,1-2H3
InChIKey
QIGAYMWEDQMZLE-UHFFFAOYSA-N
Synonyms

10((4fluorophenyl)carbonyl)33dimethyl11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5(4fluorobenzoyl)99dimethyl6(3nitrophenyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4=CC=C(C=C4)F)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C1)C
Fc1ccc(cc1)C(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CC(C2)(C)C
InChI=1SC28H24FN3O4c128(2)152225(24(33)1628)26(1865720(1418)32(35)36)31(23943821(23)3022)27(34)17101219(29)131117h3142630H1516H212H3
MFCD01471031
ZINC000001201306
ZINC000001201311

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Available files

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