Vitas-M small molecule compound
[4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)phenyl][4-(phenylsulfonyl)piperazin-1-yl]methanone
Catalog ID
STK257269
SMILES O=C(c1ccc(cc1)CN1CCc2c(C1)cccc2)N1CCN(CC1)S(=O)(=O)c1ccccc1
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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 C27H29N3O3S MW 475.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O3S/c31-27(29-16-18-30(19-17-29)34(32,33)26-8-2-1-3-9-26)24-12-10-22(11-13-24)20-28-15-14-23-6-4-5-7-25(23)21-28/h1-13H,14-21H2InChIKey
NNQZDQHHOFQFSE-UHFFFAOYSA-NSynonyms
(4(34dihydroisoquinolin2(1H)ylmethyl)phenyl)(4(phenylsulfonyl)piperazin1yl)methanone
(4(benzenesulfonyl)piperazin1yl)(4(34dihydro1Hisoquinolin2ylmethyl)phenyl)methanone
C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5
InChI=1SC27H29N3O3Sc3127(29161830(191729)34(3233)268213926)24121022(111324)2028151423645725(23)2128h113H1421H2
MFCD08683359
ZINC000019943186
ZINC19943186
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