Vitas-M small molecule compound

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

Catalog ID
STK994302
SMILES O=C(Nc1cc(Cl)ccc1O)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 C20H15ClN2O5S2 MW 462.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O5S2/c21-12-2-3-14(24)13(9-12)22-18(25)5-6-23-19(26)17(30-20(23)29)8-11-1-4-15-16(7-11)28-10-27-15/h1-4,7-9,24H,5-6,10H2,(H,22,25)/b17-8-
InChIKey
FJWPPIKNVGPDIC-IUXPMGMMSA-N
Synonyms

3((5Z)5(13BENZODIOXOL5YLMETHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(5CHLORO2HYDROXYPHENYL)PROPANAMIDE
3((5Z)5(13benzodioxol5ylmethylidene)4oxo2thioxo13thiazolidin3yl)N(5chloro2hydroxyphenyl)propanamide
3(5(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))N(5CHLORO2HYDROXYPHENYL)PROPANAMIDE
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=S)S3)CCC(=O)NC4=C(C=CC(=C4)Cl)O
InChI=1SC20H15ClN2O5S2c21122314(24)13(912)2218(25)562319(26)17(3020(23)29)811141516(711)28102715h147924H5610H2(H2225)b178
MFCD02078539
O=C(Nc1cc(Cl)ccc1O)CCN1C(=S)SC(=Cc2ccc3c(c2)OCO3)C1=O
ZINC000001237761
ZINC01237761
ZINC1237761

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Available files

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