Vitas-M small molecule compound

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

Catalog ID
STK438707
SMILES COC(=O)c1cc(sc1NC(=S)NCc1cnn(c1)CC)c1ccccc1

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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 C19H20N4O2S2 MW 400.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O2S2/c1-3-23-12-13(11-21-23)10-20-19(26)22-17-15(18(24)25-2)9-16(27-17)14-7-5-4-6-8-14/h4-9,11-12H,3,10H2,1-2H3,(H2,20,22,26)
InChIKey
RXVNROOWINSCKA-UHFFFAOYSA-N
Synonyms

CCN1C=C(C=N1)CNC(=S)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC
InChI=1SC19H20N4O2S2c13231213(112123)102019(26)221715(18(24)252)916(2717)147546814h491112H310H212H3(H2202226)
METHYL2(((((1ETHYLPYRAZOL4YL)METHYL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
methyl2((((1ethyl1Hpyrazol4yl)methyl)carbamothioyl)amino)5phenylthiophene3carboxylate
METHYL2((1ETHYLPYRAZOL4YL)METHYLCARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
MFCD03945684
ZINC000006605476
ZINC06605476
ZINC6605476

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Available files

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