Vitas-M small molecule compound

methyl 2-[(propanoylcarbamothioyl)amino]benzoate

Catalog ID
STK060734
SMILES CCC(=O)NC(=S)Nc1ccccc1C(=O)OC

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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 C12H14N2O3S MW 266.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O3S/c1-3-10(15)14-12(18)13-9-7-5-4-6-8(9)11(16)17-2/h4-7H,3H2,1-2H3,(H2,13,14,15,18)
InChIKey
FTTRSCJYVWNKOU-UHFFFAOYSA-N
Synonyms

2(3PROPIONYLTHIOUREIDO)BENZOICACIDMETHYLESTER
CCC(=O)NC(=S)NC1=CC=CC=C1C(=O)OC
CCC(=O)NC(=S)Nc1ccccc1C(=O)OC
InChI=1SC12H14N2O3Sc1310(15)1412(18)13975468(9)11(16)172h47H3H212H3(H213141518)
METHYL2(((PROPANOYLAMINO)THIOXOMETHYL)AMINO)BENZOATE
METHYL2(((PROPIONYLAMINO)CARBONOTHIOYL)AMINO)BENZOATE
METHYL2(((PROPIONYLAMINO)CARBOTHIOYL)AMINO)BENZOATE
METHYL2((PROPANOYLCARBAMOTHIOYL)AMINO)BENZOATE
METHYL2(PROPANOYLCARBAMOTHIOYLAMINO)BENZOATE
MFCD02915279
STK060734
ZINC000000455715
ZINC00455715
ZINC455715

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Available files

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