Vitas-M small molecule compound

tert-butyl N-({(2R)-1-[(4-methylphenyl)sulfonyl]piperidin-2-yl}carbonyl)-D-alaninate

Catalog ID
STL553456
SMILES O=C([C@H](NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(cc1)C)C)OC(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 C20H30N2O5S MW 410.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N2O5S/c1-14-9-11-16(12-10-14)28(25,26)22-13-7-6-8-17(22)18(23)21-15(2)19(24)27-20(3,4)5/h9-12,15,17H,6-8,13H2,1-5H3,(H,21,23)/t15-,17-/m1/s1
InChIKey
HXLIZEHBTYRIIJ-NVXWUHKLSA-N
Synonyms

(R)tertbutyl2((R)1tosylpiperidine2carboxamido)propanoate
~(tert)butyl(2~(R))2(((2~(R))1(4methylphenyl)sulfonylpiperidine2carbonyl)amino)propanoate
5573072
InChI=1SC20H30N2O5Sc11491116(121014)28(2526)221376817(22)18(23)2115(2)19(24)2720(34)5h9121517H6813H215H3(H2123)t1517m1s1
O=C((C@H)(NC(=O)C1CCCCN1S(=O)(=O)c1ccc(cc1)C)C)OC(C)(C)C
TERTBUTYL(2R)2(((2R)1(4METHYLPHENYL)SULFONYLPIPERIDINE2CARBONYL)AMINO)PROPANOATE
tertbutylN(((2R)1((4methylphenyl)sulfonyl)piperidin2yl)carbonyl)Dalaninate
ZINC000002102048
ZINC2102048

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Available files

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