Vitas-M small molecule compound
10-[(4-chlorophenyl)carbonyl]-3-(4-fluorophenyl)-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK143057
SMILES Fc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)Cl
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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 C32H23ClFN3O4 MW 568.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23ClFN3O4/c33-23-12-8-20(9-13-23)32(39)36-28-7-2-1-6-26(28)35-27-17-22(19-10-14-24(34)15-11-19)18-29(38)30(27)31(36)21-4-3-5-25(16-21)37(40)41/h1-16,22,31,35H,17-18H2InChIKey
YBNBMNSKFYNOGI-UHFFFAOYSA-NSynonyms
10((4chlorophenyl)carbonyl)3(4fluorophenyl)11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5(4chlorobenzoyl)9(4fluorophenyl)6(3nitrophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3N(C2C4=CC(=CC=C4)(N+)(=O)(O))C(=O)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)F
Fc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)(N+)(=O)(O))C(=O)c1ccc(cc1)Cl
InChI=1SC32H23ClFN3O4c332312820(91323)32(39)3628721626(28)35271722(19101424(34)151119)1829(38)30(27)31(36)2143525(1621)37(40)41h116223135H1718H2
MFCD02375501
ZINC000098045526
ZINC000098045529
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