Vitas-M small molecule compound

3-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-tert-butyl-N-(2-hydroxyethyl)propanamide

Catalog ID
STK994254
SMILES OCCN(C(C)(C)C)C(=O)CCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=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 C20H24N2O5S2 MW 436.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O5S2/c1-20(2,3)22(8-9-23)17(24)6-7-21-18(25)16(29-19(21)28)11-13-4-5-14-15(10-13)27-12-26-14/h4-5,10-11,23H,6-9,12H2,1-3H3/b16-11-
InChIKey
WHYYQUZEKAUGCG-WJDWOHSUSA-N
Synonyms

3((5Z)5(13benzodioxol5ylmethylidene)4oxo2sulfanylidene13thiazolidin3yl)NtertbutylN(2hydroxyethyl)propanamide
3((5Z)5(13benzodioxol5ylmethylidene)4oxo2thioxo13thiazolidin3yl)NtertbutylN(2hydroxyethyl)propanamide
3(5(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))N(TERTBUTYL)N(2HYDROXYETHYL)PROPANAMIDE
CC(C)(C)N(CCO)C(=O)CCN1C(=O)C(=CC2=CC3=C(C=C2)OCO3)SC1=S
InChI=1SC20H24N2O5S2c120(23)22(8923)17(24)672118(25)16(2919(21)28)1113451415(1013)27122614h45101123H6912H213H3b1611
MFCD02078635
OCCN(C(C)(C)C)C(=O)CCN1C(=S)SC(=Cc2ccc3c(c2)OCO3)C1=O
ZINC000008766122
ZINC08766122
ZINC8766122

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Available files

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