Vitas-M small molecule compound

methyl 4-{[(biphenyl-4-ylcarbonyl)carbamothioyl]amino}benzoate

Catalog ID
STK141411
SMILES COC(=O)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)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 C22H18N2O3S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O3S/c1-27-21(26)18-11-13-19(14-12-18)23-22(28)24-20(25)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-14H,1H3,(H2,23,24,25,28)
InChIKey
KZNDKYNPVQWNOY-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI=1SC22H18N2O3Sc12721(26)18111319(141218)2322(28)2420(25)179716(81017)155324615h214H1H3(H223242528)
METHYL4(((BIPHENYL4YLCARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
METHYL4((4PHENYLBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD02923055
ZINC000001181174
ZINC01181174
ZINC1181174

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Available files

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