Vitas-M small molecule compound

N-{(2S)-1-[(4-methoxyphenyl)amino]-1-oxopropan-2-yl}-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide

Catalog ID
STK558013
SMILES COc1ccc(cc1)NC(=O)[C@@H](NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)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 C23H29N3O5S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O5S/c1-16-4-10-21(11-5-16)32(29,30)26-14-12-18(13-15-26)23(28)24-17(2)22(27)25-19-6-8-20(31-3)9-7-19/h4-11,17-18H,12-15H2,1-3H3,(H,24,28)(H,25,27)/t17-/m0/s1
InChIKey
QGBIUBTYEVFMOU-KRWDZBQOSA-N
Synonyms
1013805-79-2
(S)N(1((4methoxyphenyl)amino)1oxopropan2yl)1tosylpiperidine4carboxamide
1013805792
CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C(=O)NC3=CC=C(C=C3)OC
COc1ccc(cc1)NC(=O)(C@@H)(NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C
InChI=1SC23H29N3O5Sc11641021(11516)32(2930)26141218(131526)23(28)2417(2)22(27)25196820(313)9719h4111718H1215H213H3(H2428)(H2527)t17m0s1
MFCD04029333
N((2S)1((4methoxyphenyl)amino)1oxopropan2yl)1((4methylphenyl)sulfonyl)piperidine4carboxamide
N((2S)1(4methoxyanilino)1oxopropan2yl)1(4methylphenyl)sulfonylpiperidine4carboxamide
ZINC000009460878
ZINC09460878
ZINC9460878

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Available files

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