Vitas-M small molecule compound

N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-[(5Z)-5-(3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide

Catalog ID
STK614820
SMILES OCC(Cc1ccccc1)NC(=O)CN1C(=S)S/C(=C\c2cccc(c2)OC)/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 C22H22N2O4S2 MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O4S2/c1-28-18-9-5-8-16(11-18)12-19-21(27)24(22(29)30-19)13-20(26)23-17(14-25)10-15-6-3-2-4-7-15/h2-9,11-12,17,25H,10,13-14H2,1H3,(H,23,26)/b19-12-/t17-/m1/s1
InChIKey
DFNWZEDJZXOWBG-UEXNTNOUSA-N
Synonyms
1014087-51-4
(RZ)N(1hydroxy3phenylpropan2yl)2(5(3methoxybenzylidene)4oxo2thioxothiazolidin3yl)acetamide
1014087514
COC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)NC(CC3=CC=CC=C3)CO
InChI=1SC22H22N2O4S2c1281895816(1118)121921(27)24(22(29)3019)1320(26)2317(1425)10156324715h2911121725H101314H21H3(H2326)b1912t17m1s1
MFCD18246315
N((2R)1hydroxy3phenylpropan2yl)2((5Z)5((3methoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)acetamide
N((2R)1hydroxy3phenylpropan2yl)2((5Z)5(3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetamide
OC(C@@H)(Cc1ccccc1)NC(=O)CN1C(=S)SC(=Cc2cccc(c2)OC)C1=O
OCC(Cc1ccccc1)NC(=O)CN1C(=S)SC(=Cc2cccc(c2)OC)C1=O
ZINC000009429747
ZINC09429747
ZINC9429747

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.