Vitas-M small molecule compound

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

Catalog ID
STK697396
SMILES COC(=O)c1cc(ccc1Cl)NC(=O)CN1C(=O)COc2c1cccc2

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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 C18H15ClN2O5 MW 374.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O5/c1-25-18(24)12-8-11(6-7-13(12)19)20-16(22)9-21-14-4-2-3-5-15(14)26-10-17(21)23/h2-8H,9-10H2,1H3,(H,20,22)
InChIKey
AKXPLQGNSVTMLC-UHFFFAOYSA-N
Synonyms
839693-50-4
839693504
COC(=O)C1=C(C=CC(=C1)NC(=O)CN2C(=O)COC3=CC=CC=C32)Cl
InChI=1SC18H15ClN2O5c12518(24)12811(6713(12)19)2016(22)92114423515(14)261017(21)23h28H910H21H3(H2022)
methyl2chloro5(((3oxo23dihydro4H14benzoxazin4yl)acetyl)amino)benzoate
METHYL2CHLORO5((2(3OXO14BENZOXAZIN4YL)ACETYL)AMINO)BENZOATE
methyl2chloro5(2(3oxo2Hbenzo(b)(14)oxazin4(3H)yl)acetamido)benzoate
MFCD07022758
ZINC000004770678
ZINC04770678
ZINC4770678

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Available files

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