Vitas-M small molecule compound

methyl 5-{[(3-chloro-4-methylphenyl)carbonyl]amino}-2-(morpholin-4-yl)benzoate

Catalog ID
STK188636
SMILES COC(=O)c1cc(ccc1N1CCOCC1)NC(=O)c1ccc(c(c1)Cl)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 C20H21ClN2O4 MW 388.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O4/c1-13-3-4-14(11-17(13)21)19(24)22-15-5-6-18(16(12-15)20(25)26-2)23-7-9-27-10-8-23/h3-6,11-12H,7-10H2,1-2H3,(H,22,24)
InChIKey
OKCQWXLMWCUIQV-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCOCC3)C(=O)OC)Cl
InChI=1SC20H21ClN2O4c1133414(1117(13)21)19(24)22155618(16(1215)20(25)262)23792710823h361112H710H212H3(H2224)
METHYL5(((3CHLORO4METHYLPHENYL)CARBONYL)AMINO)2(MORPHOLIN4YL)BENZOATE
METHYL5((3CHLORO4METHYLBENZOYL)AMINO)2MORPHOLIN4YLBENZOATE
MFCD06664741
ZINC000004711463
ZINC04711463
ZINC4711463

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Available files

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