Vitas-M small molecule compound

ethyl 3-({[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]carbonyl}amino)benzoate

Catalog ID
STK611436
SMILES CCOC(=O)c1cccc(c1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

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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 C21H22N4O5S2 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O5S2/c1-2-30-21(27)15-5-3-6-16(13-15)22-20(26)14-9-11-25(12-10-14)32(28,29)18-8-4-7-17-19(18)24-31-23-17/h3-8,13-14H,2,9-12H2,1H3,(H,22,26)
InChIKey
IZWLLWADNYFHGW-UHFFFAOYSA-N
Synonyms
901034-77-3
901034773
CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43
ethyl3(((1(213benzothiadiazol4ylsulfonyl)piperidin4yl)carbonyl)amino)benzoate
ethyl3((1(213benzothiadiazol4ylsulfonyl)piperidine4carbonyl)amino)benzoate
ethyl3(1(benzo(c)(125)thiadiazol4ylsulfonyl)piperidine4carboxamido)benzoate
InChI=1SC21H22N4O5S2c123021(27)1553616(1315)2220(26)1491125(121014)32(2829)188471719(18)24312317h381314H2912H21H3(H2226)
MFCD08292302
ZINC000009435852
ZINC09435852
ZINC9435852

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Available files

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