Vitas-M small molecule compound

methyl 5-chloro-3-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)thiophene-2-carboxylate

Catalog ID
STK933930
SMILES COC(=O)c1sc(cc1S(=O)(=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 C15H14ClNO4S2 MW 371.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14ClNO4S2/c1-21-15(18)14-12(8-13(16)22-14)23(19,20)17-7-6-10-4-2-3-5-11(10)9-17/h2-5,8H,6-7,9H2,1H3
InChIKey
BBPFZEULPUTHPT-UHFFFAOYSA-N
Synonyms
1212060-43-9
1212060439
COC(=O)C1=C(C=C(S1)Cl)S(=O)(=O)N2CCC3=CC=CC=C3C2
InChI=1SC15H14ClNO4S2c12115(18)1412(813(16)2214)23(1920)177610423511(10)917h258H679H21H3
methyl5chloro3((34dihydroisoquinolin2(1H)yl)sulfonyl)thiophene2carboxylate
methyl5chloro3(34dihydro1Hisoquinolin2ylsulfonyl)thiophene2carboxylate
methyl5chloro3(34dihydroisoquinolin2(1H)ylsulfonyl)thiophene2carboxylate
MFCD15147655
ZINC000044900471
ZINC44900471

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Available files

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