Vitas-M small molecule compound
1-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone
Catalog ID
STL526051
SMILES COc1cc2c(cc1O)CCN([C@H]2C)C(=O)CSc1nnc(s1)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 C16H19N3O3S2 MW 365.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O3S2/c1-9-12-7-14(22-3)13(20)6-11(12)4-5-19(9)15(21)8-23-16-18-17-10(2)24-16/h6-7,9,20H,4-5,8H2,1-3H3/t9-/m0/s1InChIKey
VXUSXFIMAAPAHC-VIFPVBQESA-NSynonyms
(R)1(6hydroxy7methoxy1methyl34dihydroisoquinolin2(1H)yl)2((5methyl134thiadiazol2yl)thio)ethanone
1((1~(S))6hydroxy7methoxy1methyl34dihydro1~(H)isoquinolin2yl)2((5methyl134thiadiazol2yl)sulfanyl)ethanone
1((1S)6HYDROXY7METHOXY1METHYL34DIHYDRO1HISOQUINOLIN2YL)2((5METHYL134THIADIAZOL2YL)SULFANYL)ETHANONE
1((1S)6hydroxy7methoxy1methyl34dihydroisoquinolin2(1H)yl)2((5methyl134thiadiazol2yl)sulfanyl)ethanone
6569503
COc1cc2c(cc1O)CCN((C@@H)2C)C(=O)CSc1nnc(s1)C
InChI=1SC16H19N3O3S2c1912714(223)13(20)611(12)4519(9)15(21)82316181710(2)2416h67920H458H213H3t9m0s1
MFCD01952806
ZINC000004063267
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