Vitas-M small molecule compound
methyl 3-methyl-11-(4-methyl-3-nitrophenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-2-carboxylate
Catalog ID
STK403693
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(Nc1c(N2)cccc1)c1ccc(c(c1)[N+](=O)[O-])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 C23H23N3O5 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O5/c1-12-8-9-14(11-18(12)26(29)30)21-20-17(24-15-6-4-5-7-16(15)25-21)10-13(2)19(22(20)27)23(28)31-3/h4-9,11,13,19,21,24-25H,10H2,1-3H3InChIKey
XRRLYOGTZUVJFH-UHFFFAOYSA-NSynonyms
CC1CC2=C(C(NC3=CC=CC=C3N2)C4=CC(=C(C=C4)C)(N+)(=O)(O))C(=O)C1C(=O)OC
COC(=O)C1C(C)CC2=C(C1=O)C(Nc1c(N2)cccc1)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC23H23N3O5c1128914(1118(12)26(29)30)212017(2415645716(15)2521)1013(2)19(22(20)27)23(28)313h49111319212425H10H213H3
methyl3methyl11(4methyl3nitrophenyl)1oxo23451011hexahydro1Hdibenzo(be)(14)diazepine2carboxylate
METHYL3METHYL11(4METHYL3NITROPHENYL)1OXO234TRIHYDRO5H10H11HBENZO(B)BENZO(34F)14DIAZEPINE2CARBOXYLATE
methyl9methyl6(4methyl3nitrophenyl)7oxo56891011hexahydrobenzo(b)(14)benzodiazepine8carboxylate
MFCD03632409
ZINC000004189091
ZINC000004189121
Check stock
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Check stock on Vitas-MAvailable files
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