Vitas-M small molecule compound
1,5-bis(3-bromopropanoyl)-4-methyl-7-nitro-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Catalog ID
STK676307
SMILES BrCCC(=O)N1C(C)CC(=O)N(c2c1cc(cc2)[N+](=O)[O-])C(=O)CCBr
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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 C16H17Br2N3O5 MW 491.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17Br2N3O5/c1-10-8-16(24)20(15(23)5-7-18)12-3-2-11(21(25)26)9-13(12)19(10)14(22)4-6-17/h2-3,9-10H,4-8H2,1H3InChIKey
BNYOUTCTHDQYRG-UHFFFAOYSA-NSynonyms
15bis(3bromopropanoyl)4methyl7nitro1345tetrahydro2H15benzodiazepin2one
15BIS(3BROMOPROPANOYL)4METHYL7NITRO34DIHYDRO15BENZODIAZEPIN2ONE
BrCCC(=O)N1C(C)CC(=O)N(c2c1cc(cc2)(N+)(=O)(O))C(=O)CCBr
CC1CC(=O)N(C2=C(N1C(=O)CCBr)C=C(C=C2)(N+)(=O)(O))C(=O)CCBr
InChI=1SC16H17Br2N3O5c110816(24)20(15(23)5718)123211(21(25)26)913(12)19(10)14(22)4617h23910H48H21H3
MFCD01872953
ZINC000098003526
ZINC000098003527
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