Vitas-M small molecule compound
(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK994332
SMILES S=C1S/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1CCC(=O)N1CCCC1
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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 C18H18N2O4S2 MW 390.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S2/c21-16(19-6-1-2-7-19)5-8-20-17(22)15(26-18(20)25)10-12-3-4-13-14(9-12)24-11-23-13/h3-4,9-10H,1-2,5-8,11H2/b15-10-InChIKey
KEBSSAMTGNICJQ-GDNBJRDFSA-NSynonyms
(5Z)5(13benzodioxol5ylmethylidene)3(3oxo3(pyrrolidin1yl)propyl)2thioxo13thiazolidin4one
(5Z)5(13BENZODIOXOL5YLMETHYLIDENE)3(3OXO3PYRROLIDIN1YLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
5(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)3(3OXO3PYRROLIDINYLPROPYL)2THIOXO13THIAZOLIDIN4ONE
C1CCN(C1)C(=O)CCN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S
InChI=1SC18H18N2O4S2c2116(19612719)582017(22)15(2618(20)25)1012341314(912)24112313h34910H125811H2b1510
MFCD02078560
S=C1SC(=Cc2ccc3c(c2)OCO3)C(=O)N1CCC(=O)N1CCCC1
ZINC000001180382
ZINC01180382
ZINC1180382
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