Vitas-M small molecule compound

N-{3-[(acetylcarbamothioyl)amino]-4-chlorophenyl}butanamide

Catalog ID
STK234291
SMILES CCCC(=O)Nc1ccc(c(c1)NC(=S)NC(=O)C)Cl

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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 C13H16ClN3O2S MW 313.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClN3O2S/c1-3-4-12(19)16-9-5-6-10(14)11(7-9)17-13(20)15-8(2)18/h5-7H,3-4H2,1-2H3,(H,16,19)(H2,15,17,18,20)
InChIKey
QIEJTLJQZCBWQK-UHFFFAOYSA-N
Synonyms
639050-64-9
639050649
CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C
InChI=1SC13H16ClN3O2Sc13412(19)1695610(14)11(79)1713(20)158(2)18h57H34H212H3(H1619)(H215171820)
MFCD03977891
N(3((acetylcarbamothioyl)amino)4chlorophenyl)butanamide
N(3(ACETYLCARBAMOTHIOYLAMINO)4CHLOROPHENYL)BUTANAMIDE
ZINC000005840222
ZINC05840222
ZINC5840222

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Available files

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