Vitas-M small molecule compound

methyl 4-({[(4-ethylphenyl)carbonyl]carbamothioyl}amino)benzoate

Catalog ID
STK209649
SMILES COC(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)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 C18H18N2O3S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S/c1-3-12-4-6-13(7-5-12)16(21)20-18(24)19-15-10-8-14(9-11-15)17(22)23-2/h4-11H,3H2,1-2H3,(H2,19,20,21,24)
InChIKey
HTVSFSXUAPSQDK-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC
InChI=1SC18H18N2O3Sc13124613(7512)16(21)2018(24)191510814(91115)17(22)232h411H3H212H3(H219202124)
METHYL4((((4ETHYLPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
METHYL4((4ETHYLBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD03723921
ZINC000000469281
ZINC00469281
ZINC469281

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Available files

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