Vitas-M small molecule compound

methyl 4-({[(1-ethyl-1H-pyrazol-4-yl)carbonyl]carbamothioyl}amino)benzoate

Catalog ID
STK317658
SMILES COC(=O)c1ccc(cc1)NC(=S)NC(=O)c1cnn(c1)CC

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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 C15H16N4O3S MW 332.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O3S/c1-3-19-9-11(8-16-19)13(20)18-15(23)17-12-6-4-10(5-7-12)14(21)22-2/h4-9H,3H2,1-2H3,(H2,17,18,20,23)
InChIKey
YDEDKKYQQKZNJJ-UHFFFAOYSA-N
Synonyms
494218-82-5
494218825
CCN1C=C(C=N1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC
InChI=1SC15H16N4O3Sc1319911(81619)13(20)1815(23)17126410(5712)14(21)222h49H3H212H3(H217182023)
METHYL4(((((1ETHYL1HPYRAZOL4YL)CARBONYL)AMINO)CARBOTHIOYL)AMINO)BENZOATE
methyl4((((1ethyl1Hpyrazol4yl)carbonyl)carbamothioyl)amino)benzoate
METHYL4((1ETHYLPYRAZOLE4CARBONYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD02374363
ZINC000002779836
ZINC02779836
ZINC2779836

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Available files

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