Vitas-M small molecule compound
2-(5-methoxy-1,3-benzothiazol-2-yl)-5-methyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK775131
SMILES COc1ccc2c(c1)nc(s2)N1C(=O)C2C(C1=O)CC(=CC2)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 C17H16N2O3S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O3S/c1-9-3-5-11-12(7-9)16(21)19(15(11)20)17-18-13-8-10(22-2)4-6-14(13)23-17/h3-4,6,8,11-12H,5,7H2,1-2H3InChIKey
JFWBHETVYAXZHJ-UHFFFAOYSA-NSynonyms
587013-09-02(5methoxy13benzothiazol2yl)5methyl3a477atetrahydro1Hisoindole13(2H)dione
2(5methoxy13benzothiazol2yl)5methyl3a477atetrahydroisoindole13dione
2(5methoxybenzo(d)thiazol2yl)5methyl3a477atetrahydro1Hisoindole13(2H)dione
587013090
CC1=CCC2C(C1)C(=O)N(C2=O)C3=NC4=C(S3)C=CC(=C4)OC
InChI=1SC17H16N2O3Sc19351112(79)16(21)19(15(11)20)171813810(222)4614(13)2317h34681112H57H212H3
MFCD03995511
ZINC000000467753
ZINC000100506422
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