Vitas-M small molecule compound

N-{[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl}-3-chloro-1-benzothiophene-2-carboxamide

Catalog ID
STK252068
SMILES CCCC(=O)N1CCN(CC1)c1ccc(cc1)NC(=S)NC(=O)c1sc2c(c1Cl)cccc2

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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 C24H25ClN4O2S2 MW 501.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN4O2S2/c1-2-5-20(30)29-14-12-28(13-15-29)17-10-8-16(9-11-17)26-24(32)27-23(31)22-21(25)18-6-3-4-7-19(18)33-22/h3-4,6-11H,2,5,12-15H2,1H3,(H2,26,27,31,32)
InChIKey
PTCDPRISGUZDMB-UHFFFAOYSA-N
Synonyms

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl
InChI=1SC24H25ClN4O2S2c12520(30)29141228(131529)1710816(91117)2624(32)2723(31)2221(25)18634719(18)3322h34611H251215H21H3(H226273132)
MFCD03650234
N((4(4BUTANOYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)3CHLORO1BENZOTHIOPHENE2CARBOXAMIDE
ZINC000004121762
ZINC04121762
ZINC4121762

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Available files

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