Vitas-M small molecule compound

methyl 4-{[(2,6-dimethylphenyl)carbamothioyl]amino}-4-oxobutanoate

Catalog ID
STK324359
SMILES COC(=O)CCC(=O)NC(=S)Nc1c(C)cccc1C

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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 C14H18N2O3S MW 294.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2O3S/c1-9-5-4-6-10(2)13(9)16-14(20)15-11(17)7-8-12(18)19-3/h4-6H,7-8H2,1-3H3,(H2,15,16,17,20)
InChIKey
RCMODDLSPYATNM-UHFFFAOYSA-N
Synonyms

CC1=C(C(=CC=C1)C)NC(=S)NC(=O)CCC(=O)OC
InChI=1SC14H18N2O3Sc1954610(2)13(9)1614(20)1511(17)7812(18)193h46H78H213H3(H215161720)
METHYL4((((26DIMETHYLPHENYL)AMINO)CARBONOTHIOYL)AMINO)4OXOBUTANOATE
methyl4(((26dimethylphenyl)carbamothioyl)amino)4oxobutanoate
METHYL4((26DIMETHYLPHENYL)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
MFCD05128072
ZINC000002888618
ZINC02888618
ZINC2888618

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Available files

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