Vitas-M small molecule compound
2,2-dimethyl-5-[5-(3-nitrophenyl)furan-2-yl]-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Catalog ID
STK757942
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1ccc(o1)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 C29H24N2O4 MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O4/c1-29(2)15-21-26-20-9-4-3-6-17(20)10-11-22(26)30-28(27(21)23(32)16-29)25-13-12-24(35-25)18-7-5-8-19(14-18)31(33)34/h3-14,28,30H,15-16H2,1-2H3InChIKey
OVOCTRDRSWJUQR-UHFFFAOYSA-NSynonyms
22dimethyl5(5(3nitrophenyl)furan2yl)1356tetrahydrobenzo(a)phenanthridin4one
22dimethyl5(5(3nitrophenyl)furan2yl)2356tetrahydrobenzo(a)phenanthridin4(1H)one
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(O5)C6=CC(=CC=C6)(N+)(=O)(O))C(=O)C1)C
InChI=1SC29H24N2O4c129(2)15212620943617(20)101122(26)3028(27(21)23(32)1629)25131224(3525)1875819(1418)31(33)34h3142830H1516H212H3
MFCD00657516
O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
ZINC000003043389
ZINC000003043392
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