Vitas-M small molecule compound

N-{[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl}-2,6-dimethoxybenzamide

Catalog ID
STK259573
SMILES CCCC(=O)N1CCN(CC1)c1ccc(cc1)NC(=S)NC(=O)c1c(OC)cccc1OC

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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 C24H30N4O4S MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O4S/c1-4-6-21(29)28-15-13-27(14-16-28)18-11-9-17(10-12-18)25-24(33)26-23(30)22-19(31-2)7-5-8-20(22)32-3/h5,7-12H,4,6,13-16H2,1-3H3,(H2,25,26,30,33)
InChIKey
JERPWDLTHYULKM-UHFFFAOYSA-N
Synonyms

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C=CC=C3OC)OC
InChI=1SC24H30N4O4Sc14621(29)28151327(141628)1811917(101218)2524(33)2623(30)2219(312)75820(22)323h5712H461316H213H3(H225263033)
MFCD04218822
N((4(4butanoylpiperazin1yl)phenyl)carbamothioyl)26dimethoxybenzamide
ZINC000009426155
ZINC09426155
ZINC9426155

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Available files

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