Vitas-M small molecule compound
N-({1-[(4-methoxyphenyl)sulfonyl]piperidin-3-yl}carbonyl)-L-valine
Catalog ID
STL011005
SMILES COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N[C@H](C(=O)O)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 C18H26N2O6S MW 398.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N2O6S/c1-12(2)16(18(22)23)19-17(21)13-5-4-10-20(11-13)27(24,25)15-8-6-14(26-3)7-9-15/h6-9,12-13,16H,4-5,10-11H2,1-3H3,(H,19,21)(H,22,23)/t13?,16-/m0/s1InChIKey
OIWONAAFHMJQRX-VYIIXAMBSA-NSynonyms
1212436-69-5(2S)2((1(4methoxyphenyl)sulfonylpiperidine3carbonyl)amino)3methylbutanoicacid
(2S)2(1((4methoxyphenyl)sulfonyl)piperidine3carboxamido)3methylbutanoicacid
1212436695
CC(C)C(C(=O)O)NC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)OC
COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N(C@H)(C(=O)O)C(C)C
InChI=1SC18H26N2O6Sc112(2)16(18(22)23)1917(21)13541020(1113)27(2425)158614(263)7915h69121316H451011H213H3(H1921)(H2223)t13?16m0s1
N((1((4methoxyphenyl)sulfonyl)piperidin3yl)carbonyl)Lvaline
ZINC000006645530
ZINC000006645531
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