Vitas-M small molecule compound

methyl 2-{[(2-oxo-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepin-1-yl)acetyl]amino}benzoate

Catalog ID
STL190079
SMILES COC(=O)c1ccccc1NC(=O)CN1C(=O)CC(=Nc2c1cccc2)c1ccccc1

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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 C25H21N3O4 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4/c1-32-25(31)18-11-5-6-12-19(18)27-23(29)16-28-22-14-8-7-13-20(22)26-21(15-24(28)30)17-9-3-2-4-10-17/h2-14H,15-16H2,1H3,(H,27,29)
InChIKey
GKVRTGWNXLLSFW-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=CC=C1NC(=O)CN2C(=O)CC(=NC3=CC=CC=C32)C4=CC=CC=C4
InChI=1SC25H21N3O4c13225(31)1811561219(18)2723(29)16282214871320(22)2621(1524(28)30)1793241017h214H1516H21H3(H2729)
methyl2(((2oxo4phenyl23dihydro1H15benzodiazepin1yl)acetyl)amino)benzoate
methyl2((2(2oxo4phenyl3H15benzodiazepin1yl)acetyl)amino)benzoate
MFCD22389563
ZINC000101354209
ZINC101354209

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.