Vitas-M small molecule compound

methyl 4-ethyl-5-methyl-2-[(pyrazin-2-ylcarbamothioyl)amino]thiophene-3-carboxylate

Catalog ID
STK455954
SMILES COC(=O)c1c(NC(=S)Nc2cnccn2)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 C14H16N4O2S2 MW 336.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O2S2/c1-4-9-8(2)22-12(11(9)13(19)20-3)18-14(21)17-10-7-15-5-6-16-10/h5-7H,4H2,1-3H3,(H2,16,17,18,21)
InChIKey
HIYBNHNGPUNRLE-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2=NC=CN=C2)C
InChI=1SC14H16N4O2S2c1498(2)2212(11(9)13(19)203)1814(21)1710715561610h57H4H213H3(H216171821)
METHYL4ETHYL5METHYL2(((PYRAZIN2YLAMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl4ethyl5methyl2((pyrazin2ylcarbamothioyl)amino)thiophene3carboxylate
METHYL4ETHYL5METHYL2(PYRAZIN2YLCARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
MFCD04228693
ZINC000000611831
ZINC00611831
ZINC611831

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Available files

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