Vitas-M small molecule compound
6-{[4-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK469892
SMILES O=C(C1CC=CCC1C(=O)O)Nc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cccc2
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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 C23H24N2O5S MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O5S/c26-22(20-7-3-4-8-21(20)23(27)28)24-18-9-11-19(12-10-18)31(29,30)25-14-13-16-5-1-2-6-17(16)15-25/h1-6,9-12,20-21H,7-8,13-15H2,(H,24,26)(H,27,28)InChIKey
KWJCUVXJKMVUQY-UHFFFAOYSA-NSynonyms
6((4(34dihydro1Hisoquinolin2ylsulfonyl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
6((4(34dihydroisoquinolin2(1H)ylsulfonyl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4CC=CCC4C(=O)O
InChI=1SC23H24N2O5Sc2622(20734821(20)23(27)28)241891119(121018)31(2930)25141316512617(16)1525h169122021H781315H2(H2426)(H2728)
MFCD06084730
ZINC000019631862
ZINC000019631871
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