Vitas-M small molecule compound

3-methyl-N-{[4-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl}butanamide

Catalog ID
STK252072
SMILES CCC(=O)N1CCN(CC1)c1ccc(cc1)NC(=S)NC(=O)CC(C)C

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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 C19H28N4O2S MW 376.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N4O2S/c1-4-18(25)23-11-9-22(10-12-23)16-7-5-15(6-8-16)20-19(26)21-17(24)13-14(2)3/h5-8,14H,4,9-13H2,1-3H3,(H2,20,21,24,26)
InChIKey
WZXZEPJWNBYPEX-UHFFFAOYSA-N
Synonyms

3METHYLN(((4(4PROPANOYLPIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)BUTANAMIDE
3METHYLN((4(4PROPANOYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)BUTANAMIDE
CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CC(C)C
InChI=1SC19H28N4O2Sc1418(25)2311922(101223)167515(6816)2019(26)2117(24)1314(2)3h5814H4913H213H3(H220212426)
MFCD03650190
ZINC000004121431
ZINC04121431
ZINC4121431

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Available files

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