Vitas-M small molecule compound

N-benzyl-2-[(3,4-dimethoxyphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Catalog ID
STK724549
SMILES COc1ccc(cc1OC)S(=O)(=O)N1Cc2ccccc2CC1C(=O)NCc1ccccc1

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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 C25H26N2O5S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5S/c1-31-23-13-12-21(15-24(23)32-2)33(29,30)27-17-20-11-7-6-10-19(20)14-22(27)25(28)26-16-18-8-4-3-5-9-18/h3-13,15,22H,14,16-17H2,1-2H3,(H,26,28)
InChIKey
WDVQXUMLSKADQQ-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCC4=CC=CC=C4)OC
InChI=1SC25H26N2O5Sc13123131221(1524(23)322)33(2930)27172011761019(20)1422(27)25(28)2616188435918h3131522H141617H212H3(H2628)
MFCD04215281
Nbenzyl2((34dimethoxyphenyl)sulfonyl)1234tetrahydroisoquinoline3carboxamide
NBENZYL2(34DIMETHOXYPHENYL)SULFONYL34DIHYDRO1HISOQUINOLINE3CARBOXAMIDE
ZINC000002842999
ZINC000002843000

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Available files

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