Vitas-M small molecule compound

ethyl 5-{[4-(methylsulfanyl)benzyl]amino}-2-(morpholin-4-yl)benzoate

Catalog ID
STK188634
SMILES CCOC(=O)c1cc(NCc2ccc(cc2)SC)ccc1N1CCOCC1

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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 C21H26N2O3S MW 386.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3S/c1-3-26-21(24)19-14-17(6-9-20(19)23-10-12-25-13-11-23)22-15-16-4-7-18(27-2)8-5-16/h4-9,14,22H,3,10-13,15H2,1-2H3
InChIKey
FHJBLSLAOWJXIR-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(C=CC(=C1)NCC2=CC=C(C=C2)SC)N3CCOCC3
ETHYL5((4(METHYLSULFANYL)BENZYL)AMINO)2(MORPHOLIN4YL)BENZOATE
ETHYL5((4METHYLSULFANYLPHENYL)METHYLAMINO)2MORPHOLIN4YLBENZOATE
InChI=1SC21H26N2O3Sc132621(24)191417(6920(19)23101225131123)2215164718(272)8516h491422H3101315H212H3
MFCD06664739
ZINC000004705487
ZINC04705487
ZINC4705487

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Available files

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