Vitas-M small molecule compound

methyl 4-ethyl-5-methyl-2-({[3-(2-oxopyrrolidin-1-yl)propyl]carbamothioyl}amino)thiophene-3-carboxylate

Catalog ID
STK455908
SMILES COC(=O)c1c(NC(=S)NCCCN2CCCC2=O)sc(c1CC)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 C17H25N3O3S2 MW 383.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O3S2/c1-4-12-11(2)25-15(14(12)16(22)23-3)19-17(24)18-8-6-10-20-9-5-7-13(20)21/h4-10H2,1-3H3,(H2,18,19,24)
InChIKey
SLJTUWZXBLJKQU-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC)NC(=S)NCCCN2CCCC2=O)C
InChI=1SC17H25N3O3S2c141211(2)2515(14(12)16(22)233)1917(24)1886102095713(20)21h410H213H3(H2181924)
METHYL4ETHYL5METHYL2((((3(2OXOPYRROLIDINYL)PROPYL)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl4ethyl5methyl2(((3(2oxopyrrolidin1yl)propyl)carbamothioyl)amino)thiophene3carboxylate
methyl4ethyl5methyl2(3(2oxopyrrolidin1yl)propylcarbamothioylamino)thiophene3carboxylate
MFCD04226957
ZINC000006955740
ZINC06955740
ZINC6955740

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Available files

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