Vitas-M small molecule compound
(2S)-3-methyl-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanamide
Catalog ID
STL303678
SMILES CC([C@H](N1Cc2c(C1=O)cccc2)C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)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 C21H21N3O4S2 MW 443.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S2/c1-12(2)18(24-11-13-6-4-5-7-15(13)20(24)26)19(25)23-21-22-16-9-8-14(30(3,27)28)10-17(16)29-21/h4-10,12,18H,11H2,1-3H3,(H,22,23,25)/t18-/m0/s1InChIKey
MUCYDPHRSQODPK-SFHVURJKSA-NSynonyms
1212131-05-9(2S)3methylN(6(methylsulfonyl)13benzothiazol2yl)2(1oxo13dihydro2Hisoindol2yl)butanamide
(2S)3methylN(6methylsulfonyl13benzothiazol2yl)2(3oxo1Hisoindol2yl)butanamide
(S)3methylN(6(methylsulfonyl)benzo(d)thiazol2yl)2(1oxoisoindolin2yl)butanamide
1212131059
CC((C@H)(N1Cc2c(C1=O)cccc2)C(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)C
CC(C)C(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)N3CC4=CC=CC=C4C3=O
InChI=1SC21H21N3O4S2c112(2)18(241113645715(13)20(24)26)19(25)232122169814(30(327)28)1017(16)2921h4101218H11H213H3(H222325)t18m0s1
ZINC000020745178
ZINC20745178
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