Vitas-M small molecule compound
2-[(5Z)-5-(2,5-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[(3S,4R)-4-hydroxytetrahydrothiophen-3-yl]acetamide
Catalog ID
STK641161
SMILES COc1ccc(cc1/C=C/1\SC(=S)N(C1=O)CC(=O)N[C@@H]1CSC[C@@H]1O)OC
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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 C18H20N2O5S3 MW 440.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O5S3/c1-24-11-3-4-14(25-2)10(5-11)6-15-17(23)20(18(26)28-15)7-16(22)19-12-8-27-9-13(12)21/h3-6,12-13,21H,7-9H2,1-2H3,(H,19,22)/b15-6-/t12-,13+/m1/s1InChIKey
YNOZPCPYXFDODM-IWDIYUMISA-NSynonyms
2((5Z)5((25dimethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)N((3S4R)4hydroxythiolan3yl)acetamide
2((5Z)5(25dimethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)N((3S4R)4hydroxytetrahydrothiophen3yl)acetamide
2((Z)5(25dimethoxybenzylidene)4oxo2thioxothiazolidin3yl)N((3S4R)4hydroxytetrahydrothiophen3yl)acetamide
COC1=CC(=C(C=C1)OC)C=C2C(=O)N(C(=S)S2)CC(=O)NC3CSCC3O
COc1ccc(cc1C=C1SC(=S)N(C1=O)CC(=O)N(C@@H)1CSC(C@@H)1O)OC
InChI=1SC18H20N2O5S3c124113414(252)10(511)61517(23)20(18(26)2815)716(22)1912827913(12)21h36121321H79H212H3(H1922)b156t1213+m1s1
MFCD18246685
ZINC000012390333
ZINC12390333
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