Vitas-M small molecule compound

tert-butyl 4-[(2,1,3-benzothiadiazol-4-yloxy)acetyl]piperazine-1-carboxylate

Catalog ID
STK631504
SMILES O=C(N1CCN(CC1)C(=O)OC(C)(C)C)COc1cccc2c1nsn2

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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 C17H22N4O4S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O4S/c1-17(2,3)25-16(23)21-9-7-20(8-10-21)14(22)11-24-13-6-4-5-12-15(13)19-26-18-12/h4-6H,7-11H2,1-3H3
InChIKey
AAFLKPUSAJXRSQ-UHFFFAOYSA-N
Synonyms
1010925-00-4
1010925004
CC(C)(C)OC(=O)N1CCN(CC1)C(=O)COC2=CC=CC3=NSN=C32
InChI=1SC17H22N4O4Sc117(23)2516(23)219720(81021)14(22)1124136451215(13)19261812h46H711H213H3
MFCD12203114
tertbutyl4((213benzothiadiazol4yloxy)acetyl)piperazine1carboxylate
tertbutyl4(2(213benzothiadiazol4yloxy)acetyl)piperazine1carboxylate
tertbutyl4(2(benzo(c)(125)thiadiazol4yloxy)acetyl)piperazine1carboxylate
ZINC000012391783
ZINC12391783

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Available files

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