Vitas-M small molecule compound

methyl N-({4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}carbonyl)-L-phenylalaninate

Catalog ID
STK654792
SMILES COC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)OC

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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 C22H27N3O6S MW 461.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O6S/c1-30-18-8-10-19(11-9-18)32(28,29)25-14-12-24(13-15-25)22(27)23-20(21(26)31-2)16-17-6-4-3-5-7-17/h3-11,20H,12-16H2,1-2H3,(H,23,27)/t20-/m0/s1
InChIKey
IZMDMGYKWBEHGM-FQEVSTJZSA-N
Synonyms
1175742-73-0
(S)methyl2(4((4methoxyphenyl)sulfonyl)piperazine1carboxamido)3phenylpropanoate
1175742730
COC(=O)(C@H)(Cc1ccccc1)NC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)OC
COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC
InChI=1SC22H27N3O6Sc1301881019(11918)32(2829)25141224(131525)22(27)2320(21(26)312)16176435717h31120H1216H212H3(H2327)t20m0s1
methyl(2S)2((4(4methoxyphenyl)sulfonylpiperazine1carbonyl)amino)3phenylpropanoate
methylN((4((4methoxyphenyl)sulfonyl)piperazin1yl)carbonyl)Lphenylalaninate
MFCD18167143
ZINC000032094105
ZINC32094105

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Available files

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