Vitas-M small molecule compound

methyl 3-[({3-[methyl(phenylsulfonyl)amino]thiophen-2-yl}carbonyl)amino]benzoate

Catalog ID
STL104650
SMILES COC(=O)c1cccc(c1)NC(=O)c1sccc1N(S(=O)(=O)c1ccccc1)C

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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 C20H18N2O5S2 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S2/c1-22(29(25,26)16-9-4-3-5-10-16)17-11-12-28-18(17)19(23)21-15-8-6-7-14(13-15)20(24)27-2/h3-13H,1-2H3,(H,21,23)
InChIKey
FDCNQAHPYRDFSV-UHFFFAOYSA-N
Synonyms
1116017-49-2
1116017492
CN(C1=C(SC=C1)C(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C3=CC=CC=C3
InChI=1SC20H18N2O5S2c122(29(2526)1694351016)1711122818(17)19(23)211586714(1315)20(24)272h313H12H3(H2123)
methyl3(((3(methyl(phenylsulfonyl)amino)thiophen2yl)carbonyl)amino)benzoate
methyl3((3(benzenesulfonyl(methyl)amino)thiophene2carbonyl)amino)benzoate
METHYL3(3(NMETHYLPHENYLSULFONAMIDO)THIOPHENE2CARBOXAMIDO)BENZOATE
MFCD15136026
ZINC000033141786
ZINC33141786

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Available files

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