Vitas-M small molecule compound

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

Catalog ID
STK437068
SMILES COC(=O)c1c(NC(=S)NCc2cnn(c2)C)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 C15H20N4O2S2 MW 352.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N4O2S2/c1-5-11-9(2)23-13(12(11)14(20)21-4)18-15(22)16-6-10-7-17-19(3)8-10/h7-8H,5-6H2,1-4H3,(H2,16,18,22)
InChIKey
LEUDHQRFEFKFCE-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=CN(N=C2)C)C
InChI=1SC15H20N4O2S2c15119(2)2313(12(11)14(20)214)1815(22)1661071719(3)810h78H56H214H3(H2161822)
METHYL4ETHYL5METHYL2(((((1METHYLPYRAZOL4YL)METHYL)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl4ethyl5methyl2((((1methyl1Hpyrazol4yl)methyl)carbamothioyl)amino)thiophene3carboxylate
METHYL4ETHYL5METHYL2((1METHYLPYRAZOL4YL)METHYLCARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03945061
ZINC000017073096
ZINC17073096

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Available files

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