Vitas-M small molecule compound

2-methyl-N-(2,2,2-trichloro-1-{[(1,1-dioxidotetrahydrothiophen-3-yl)carbamothioyl]amino}ethyl)propanamide

Catalog ID
STK809666
SMILES S=C(NC(C(Cl)(Cl)Cl)NC(=O)C(C)C)NC1CCS(=O)(=O)C1

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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 C11H18Cl3N3O3S2 MW 410.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H18Cl3N3O3S2/c1-6(2)8(18)16-9(11(12,13)14)17-10(21)15-7-3-4-22(19,20)5-7/h6-7,9H,3-5H2,1-2H3,(H,16,18)(H2,15,17,21)
InChIKey
IBYYVEJYNOPOAS-UHFFFAOYSA-N
Synonyms

2methylN(222trichloro1(((11dioxidotetrahydrothiophen3yl)carbamothioyl)amino)ethyl)propanamide
2METHYLN(222TRICHLORO1((11DIOXOTHIOLAN3YL)CARBAMOTHIOYLAMINO)ETHYL)PROPANAMIDE
CC(C)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1CCS(=O)(=O)C1
InChI=1SC11H18Cl3N3O3S2c16(2)8(18)169(11(1213)14)1710(21)1573422(1920)57h679H35H212H3(H1618)(H2151721)
MFCD00628267
N(222TRICHLORO1(3(11DIOXOTETRAHYDRO1LAMBDA6THIOPHEN3YL)THIOUREIDO)ETHYL)ISOBUTYRAMIDE
ZINC000008828586
ZINC000008828589

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Available files

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