Vitas-M small molecule compound

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

Catalog ID
STK252070
SMILES CCC(=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 C23H23ClN4O2S2 MW 487.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN4O2S2/c1-2-19(29)28-13-11-27(12-14-28)16-9-7-15(8-10-16)25-23(31)26-22(30)21-20(24)17-5-3-4-6-18(17)32-21/h3-10H,2,11-14H2,1H3,(H2,25,26,30,31)
InChIKey
NKUTVEHSHVITKK-UHFFFAOYSA-N
Synonyms

(3CHLOROBENZO(B)THIOPHEN2YL)N(((4(4PROPANOYLPIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
3CHLORON((4(4PROPANOYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)1BENZOTHIOPHENE2CARBOXAMIDE
CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl
InChI=1SC23H23ClN4O2S2c1219(29)28131127(121428)169715(81016)2523(31)2622(30)2120(24)17534618(17)3221h310H21114H21H3(H225263031)
MFCD03650192
ZINC000004121479
ZINC04121479
ZINC4121479

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Available files

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