Vitas-M small molecule compound
1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-(tert-butylamino)-1-oxopropan-2-yl]piperidine-3-carboxamide
Catalog ID
STK637037
SMILES O=C([C@@H](NC(=O)C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)C)NC(C)(C)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 C19H27N5O4S2 MW 453.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N5O4S2/c1-12(17(25)21-19(2,3)4)20-18(26)13-7-6-10-24(11-13)30(27,28)15-9-5-8-14-16(15)23-29-22-14/h5,8-9,12-13H,6-7,10-11H2,1-4H3,(H,20,26)(H,21,25)/t12-,13?/m0/s1InChIKey
AGGQQJJLYBBDQQ-UEWDXFNNSA-NSynonyms
1212453-84-31(213benzothiadiazol4ylsulfonyl)N((2S)1(tertbutylamino)1oxopropan2yl)piperidine3carboxamide
1(benzo(c)(125)thiadiazol4ylsulfonyl)N((S)1(tertbutylamino)1oxopropan2yl)piperidine3carboxamide
1212453843
CC(C(=O)NC(C)(C)C)NC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=CC3=NSN=C32
InChI=1SC19H27N5O4S2c112(17(25)2119(23)4)2018(26)13761024(1113)30(2728)159581416(15)23292214h5891213H671011H214H3(H2026)(H2125)t1213?m0s1
MFCD18161248
O=C((C@@H)(NC(=O)C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)C)NC(C)(C)C
ZINC000012408514
ZINC000012408515
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