Vitas-M small molecule compound

{1-[(5-chloro-2-ethoxyphenyl)sulfonyl]piperidin-3-yl}(3,4-dihydroisoquinolin-2(1H)-yl)methanone

Catalog ID
STK274430
SMILES CCOc1ccc(cc1S(=O)(=O)N1CCCC(C1)C(=O)N1CCc2c(C1)cccc2)Cl

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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 C23H27ClN2O4S MW 463.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN2O4S/c1-2-30-21-10-9-20(24)14-22(21)31(28,29)26-12-5-8-19(16-26)23(27)25-13-11-17-6-3-4-7-18(17)15-25/h3-4,6-7,9-10,14,19H,2,5,8,11-13,15-16H2,1H3
InChIKey
PUFJEOIALZYPKI-UHFFFAOYSA-N
Synonyms

(1((5chloro2ethoxyphenyl)sulfonyl)piperidin3yl)(34dihydroisoquinolin2(1H)yl)methanone
(1(5chloro2ethoxyphenyl)sulfonylpiperidin3yl)(34dihydro1Hisoquinolin2yl)methanone
CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCCC(C2)C(=O)N3CCC4=CC=CC=C4C3
InChI=1SC23H27ClN2O4Sc12302110920(24)1422(21)31(2829)26125819(1626)23(27)25131117634718(17)1525h34679101419H25811131516H21H3
MFCD09268628
ZINC000013858220
ZINC000013858221

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Available files

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