Vitas-M small molecule compound
8,9-diethoxy-4-(3-nitrophenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine
Catalog ID
STK681141
SMILES CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)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 C22H23N3O4 MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4/c1-3-28-20-12-16-14-23-22(15-7-5-8-17(11-15)25(26)27)18-9-6-10-24(18)19(16)13-21(20)29-4-2/h5-13,22-23H,3-4,14H2,1-2H3InChIKey
YWWYSTOSFIJSSX-UHFFFAOYSA-NSynonyms
89diethoxy4(3nitrophenyl)56dihydro4Hpyrrolo(12a)(14)benzodiazepine
CCOC1=C(C=C2C(=C1)CNC(C3=CC=CN32)C4=CC(=CC=C4)(N+)(=O)(O))OCC
CCOc1cc2c(cc1OCC)CNC(c1n2ccc1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H23N3O4c1328201216142322(1575817(1115)25(26)27)18961024(18)19(16)1321(20)2942h5132223H3414H212H3
MFCD03768294
ZINC000055211421
ZINC000055211422
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