Vitas-M small molecule compound

methyl 2-({[3-(4-methoxyphenyl)thiomorpholin-4-yl]carbonyl}amino)benzoate

Catalog ID
STK657812
SMILES COc1ccc(cc1)C1CSCCN1C(=O)Nc1ccccc1C(=O)OC

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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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c1-25-15-9-7-14(8-10-15)18-13-27-12-11-22(18)20(24)21-17-6-4-3-5-16(17)19(23)26-2/h3-10,18H,11-13H2,1-2H3,(H,21,24)
InChIKey
DBBBMKOQKSHYBJ-UHFFFAOYSA-N
Synonyms
1144477-38-2
1144477382
COC1=CC=C(C=C1)C2CSCCN2C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC20H22N2O4Sc125159714(81015)181327121122(18)20(24)2117643516(17)19(23)262h31018H1113H212H3(H2124)
methyl2(((3(4methoxyphenyl)thiomorpholin4yl)carbonyl)amino)benzoate
methyl2((3(4methoxyphenyl)thiomorpholine4carbonyl)amino)benzoate
methyl2(3(4methoxyphenyl)thiomorpholine4carboxamido)benzoate
MFCD12213631
ZINC000032091428
ZINC000032091431

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Available files

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