Vitas-M small molecule compound

methyl 2-{[(2,2-dimethylpropanoyl)carbamothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK324362
SMILES COC(=O)c1c(NC(=S)NC(=O)C(C)(C)C)sc2c1CCC2

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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 C15H20N2O3S2 MW 340.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N2O3S2/c1-15(2,3)13(19)17-14(21)16-11-10(12(18)20-4)8-6-5-7-9(8)22-11/h5-7H2,1-4H3,(H2,16,17,19,21)
InChIKey
AFFBILSSGXPTQB-UHFFFAOYSA-N
Synonyms

CC(C)(C)C(=O)NC(=S)NC1=C(C2=C(S1)CCC2)C(=O)OC
InChI=1SC15H20N2O3S2c115(23)13(19)1714(21)161110(12(18)204)86579(8)2211h57H214H3(H216171921)
METHYL2((((22DIMETHYLPROPANOYL)AMINO)CARBOTHIOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
methyl2(((22dimethylpropanoyl)carbamothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2(22DIMETHYLPROPANOYLCARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD05127797
ZINC000004810703
ZINC04810703
ZINC4810703

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Available files

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