Vitas-M small molecule compound
2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Catalog ID
STK618823
SMILES O=C(CN1C(=S)S/C(=C/c2ccc3c(c2)OCO3)/C1=O)NCCCN1CCCC1=O
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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 C20H21N3O5S2 MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5S2/c24-17(21-6-2-8-22-7-1-3-18(22)25)11-23-19(26)16(30-20(23)29)10-13-4-5-14-15(9-13)28-12-27-14/h4-5,9-10H,1-3,6-8,11-12H2,(H,21,24)/b16-10+InChIKey
HNQHKWCTRKYMPP-MHWRWJLKSA-NSynonyms
929824-03-3(E)2(5(benzo(d)(13)dioxol5ylmethylene)4oxo2thioxothiazolidin3yl)N(3(2oxopyrrolidin1yl)propyl)acetamide
2((5E)5(13benzodioxol5ylmethylidene)4oxo2sulfanylidene13thiazolidin3yl)N(3(2oxopyrrolidin1yl)propyl)acetamide
2((5E)5(13benzodioxol5ylmethylidene)4oxo2thioxo13thiazolidin3yl)N(3(2oxopyrrolidin1yl)propyl)acetamide
929824033
C1CC(=O)N(C1)CCCNC(=O)CN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S
InChI=1SC20H21N3O5S2c2417(216282271318(22)25)112319(26)16(3020(23)29)1013451415(913)28122714h45910H13681112H2(H2124)b1610+
MFCD09845771
O=C(CN1C(=S)SC(=Cc2ccc3c(c2)OCO3)C1=O)NCCCN1CCCC1=O
ZINC000009531139
ZINC09531139
ZINC9531139
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