Vitas-M small molecule compound

N-{[3-chloro-4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl}-3,4-dimethoxybenzamide

Catalog ID
STK390018
SMILES COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCC(CC1)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 C22H26ClN3O3S MW 447.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClN3O3S/c1-14-8-10-26(11-9-14)18-6-5-16(13-17(18)23)24-22(30)25-21(27)15-4-7-19(28-2)20(12-15)29-3/h4-7,12-14H,8-11H2,1-3H3,(H2,24,25,27,30)
InChIKey
UFDZTBWYLCBWDN-UHFFFAOYSA-N
Synonyms

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)OC)Cl
InChI=1SC22H26ClN3O3Sc11481026(11914)186516(1317(18)23)2422(30)2521(27)154719(282)20(1215)293h471214H811H213H3(H224252730)
MFCD06007425
N((3chloro4(4methylpiperidin1yl)phenyl)carbamothioyl)34dimethoxybenzamide
ZINC000016447502
ZINC16447502

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Available files

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