Vitas-M small molecule compound

N-{[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl}butanamide

Catalog ID
STK892078
SMILES CCCC(=O)NC(=S)Nc1cc(Cl)ccc1N1CCN(CC1)C(=O)CC

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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 C18H25ClN4O2S MW 396.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25ClN4O2S/c1-3-5-16(24)21-18(26)20-14-12-13(19)6-7-15(14)22-8-10-23(11-9-22)17(25)4-2/h6-7,12H,3-5,8-11H2,1-2H3,(H2,20,21,24,26)
InChIKey
FEILPXMCNGUDJN-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC(=S)NC1=C(C=CC(=C1)Cl)N2CCN(CC2)C(=O)CC
InChI=1SC18H25ClN4O2Sc13516(24)2118(26)20141213(19)6715(14)2281023(11922)17(25)42h6712H35811H212H3(H220212426)
MFCD05832107
N((5chloro2(4propanoylpiperazin1yl)phenyl)carbamothioyl)butanamide
NBUTYRYLN(5CHLORO2(4PROPIONYL1PIPERAZINYL)PHENYL)THIOUREA
ZINC000001059043
ZINC01059043
ZINC1059043

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Available files

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