Vitas-M small molecule compound

{2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinolin-3-yl}(4-methylpiperazin-1-yl)methanone

Catalog ID
STL009905
SMILES CN1CCN(CC1)C(=O)C1Cc2ccccc2CN1S(=O)(=O)c1ccc(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 C22H27N3O3S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3S/c1-17-7-9-20(10-8-17)29(27,28)25-16-19-6-4-3-5-18(19)15-21(25)22(26)24-13-11-23(2)12-14-24/h3-10,21H,11-16H2,1-2H3
InChIKey
QCWQCRUAJRXJRH-UHFFFAOYSA-N
Synonyms
1050260-87-1
(2((4methylphenyl)sulfonyl)1234tetrahydroisoquinolin3yl)(4methylpiperazin1yl)methanone
(2(4methylphenyl)sulfonyl34dihydro1Hisoquinolin3yl)(4methylpiperazin1yl)methanone
(4methylpiperazin1yl)(2tosyl1234tetrahydroisoquinolin3yl)methanone
1050260871
CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)N4CCN(CC4)C
InChI=1SC22H27N3O3Sc1177920(10817)29(2728)251619643518(19)1521(25)22(26)24131123(2)121424h31021H1116H212H3
MFCD08744003
ZINC000020591911
ZINC000020591913

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Available files

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