Vitas-M small molecule compound

methyl 2-({[5-(1,1-dioxido-1,2-thiazinan-2-yl)-2-methoxyphenyl]sulfonyl}amino)benzoate

Catalog ID
STK643313
SMILES COC(=O)c1ccccc1NS(=O)(=O)c1cc(ccc1OC)N1CCCCS1(=O)=O

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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 C19H22N2O7S2 MW 454.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O7S2/c1-27-17-10-9-14(21-11-5-6-12-29(21,23)24)13-18(17)30(25,26)20-16-8-4-3-7-15(16)19(22)28-2/h3-4,7-10,13,20H,5-6,11-12H2,1-2H3
InChIKey
ODSYAAYXYAFCAK-UHFFFAOYSA-N
Synonyms
920115-83-9
920115839
COC1=C(C=C(C=C1)N2CCCCS2(=O)=O)S(=O)(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC19H22N2O7S2c1271710914(2111561229(2123)24)1318(17)30(2526)2016843715(16)19(22)282h347101320H561112H212H3
methyl2(((5(11dioxido12thiazinan2yl)2methoxyphenyl)sulfonyl)amino)benzoate
methyl2((5(11dioxothiazinan2yl)2methoxyphenyl)sulfonylamino)benzoate
methyl2(5(11dioxido12thiazinan2yl)2methoxyphenylsulfonamido)benzoate
MFCD10044409
ZINC000011906665
ZINC11906665

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Available files

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