Vitas-M small molecule compound

N-[4-(dimethylamino)benzyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-fluorophenoxy)propanamide

Catalog ID
STK705753
SMILES Fc1ccc(cc1)OC(C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)N(C)C)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 C22H27FN2O4S MW 434.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27FN2O4S/c1-16(29-21-10-6-18(23)7-11-21)22(26)25(20-12-13-30(27,28)15-20)14-17-4-8-19(9-5-17)24(2)3/h4-11,16,20H,12-15H2,1-3H3
InChIKey
SDCUKTCFDLOLLH-UHFFFAOYSA-N
Synonyms
620561-86-6
(2R)N(4(DIMETHYLAMINO)BENZYL)N((3R)11DIOXIDOTETRAHYDROTHIOPHEN3YL)2(4FLUOROPHENOXY)PROPANAMIDE
(2S)N(4(DIMETHYLAMINO)BENZYL)N((3R)11DIOXIDOTETRAHYDROTHIOPHEN3YL)2(4FLUOROPHENOXY)PROPANAMIDE
620561866
CC(C(=O)N(CC1=CC=C(C=C1)N(C)C)C2CCS(=O)(=O)C2)OC3=CC=C(C=C3)F
InChI=1SC22H27FN2O4Sc116(292110618(23)71121)22(26)25(20121330(2728)1520)14174819(9517)24(2)3h4111620H1215H213H3
MFCD04195164
N((4(dimethylamino)phenyl)methyl)N(11dioxothiolan3yl)2(4fluorophenoxy)propanamide
N((4DIMETHYLAMINOPHENYL)METHYL)N(11DIOXOTHIOLAN3YL)2(4FLUOROPHENOXY)PROPANAMIDE
N(4(dimethylamino)benzyl)N(11dioxidotetrahydrothiophen3yl)2(4fluorophenoxy)propanamide
ZINC000002432701
ZINC000009210102

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Available files

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