Vitas-M small molecule compound

N-{[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl}-3-chloro-4-methoxybenzamide

Catalog ID
STK259650
SMILES CCCC(=O)N1CCN(CC1)c1ccc(cc1)NC(=S)NC(=O)c1ccc(c(c1)Cl)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 C23H27ClN4O3S MW 475.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN4O3S/c1-3-4-21(29)28-13-11-27(12-14-28)18-8-6-17(7-9-18)25-23(32)26-22(30)16-5-10-20(31-2)19(24)15-16/h5-10,15H,3-4,11-14H2,1-2H3,(H2,25,26,30,32)
InChIKey
FUWJBJDPIBBDSK-UHFFFAOYSA-N
Synonyms

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)Cl
InChI=1SC23H27ClN4O3Sc13421(29)28131127(121428)188617(7918)2523(32)2622(30)1651020(312)19(24)1516h51015H341114H212H3(H225263032)
MFCD03849059
N(((4(4BUTANOYLPIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)(3CHLORO4METHOXYPHENYL)CARBOXAMIDE
N((4(4butanoylpiperazin1yl)phenyl)carbamothioyl)3chloro4methoxybenzamide
ZINC000004121782
ZINC04121782
ZINC4121782

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Available files

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