Vitas-M small molecule compound

methyl 1-[(4-{[(4-methylpiperazin-1-yl)sulfonyl]methyl}phenyl)carbonyl]piperidine-4-carboxylate

Catalog ID
STL292682
SMILES COC(=O)C1CCN(CC1)C(=O)c1ccc(cc1)CS(=O)(=O)N1CCN(CC1)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 C20H29N3O5S MW 423.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3O5S/c1-21-11-13-23(14-12-21)29(26,27)15-16-3-5-17(6-4-16)19(24)22-9-7-18(8-10-22)20(25)28-2/h3-6,18H,7-15H2,1-2H3
InChIKey
NYMDYAMXBFFJDW-UHFFFAOYSA-N
Synonyms

CN1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)OC
InChI=1SC20H29N3O5Sc121111323(141221)29(2627)15163517(6416)19(24)229718(81022)20(25)282h3618H715H212H3
methyl1((4(((4methylpiperazin1yl)sulfonyl)methyl)phenyl)carbonyl)piperidine4carboxylate
methyl1(4((4methylpiperazin1yl)sulfonylmethyl)benzoyl)piperidine4carboxylate
MFCD19026912
ZINC000067601861
ZINC67601861

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Available files

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