Vitas-M small molecule compound

methyl 4-[(Z)-(3-{[(3-hydroxyphenyl)carbonyl]amino}-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzoate

Catalog ID
STK835840
SMILES COC(=O)c1ccc(cc1)/C=C/1\SC(=S)N(C1=O)NC(=O)c1cccc(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 C19H14N2O5S2 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14N2O5S2/c1-26-18(25)12-7-5-11(6-8-12)9-15-17(24)21(19(27)28-15)20-16(23)13-3-2-4-14(22)10-13/h2-10,22H,1H3,(H,20,23)/b15-9-
InChIKey
QKXYAXIRRUUVLV-DHDCSXOGSA-N
Synonyms
314746-49-1
(Z)methyl4((3(3hydroxybenzamido)4oxo2thioxothiazolidin5ylidene)methyl)benzoate
314746491
COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC(=CC=C3)O
COC(=O)c1ccc(cc1)C=C1SC(=S)N(C1=O)NC(=O)c1cccc(c1)O
InChI=1SC19H14N2O5S2c12618(25)127511(6812)91517(24)21(19(27)2815)2016(23)1332414(22)1013h21022H1H3(H2023)b159
METHYL4((3((3HYDROXYPHENYL)CARBONYLAMINO)4OXO2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
methyl4((Z)(3(((3hydroxyphenyl)carbonyl)amino)4oxo2thioxo13thiazolidin5ylidene)methyl)benzoate
METHYL4((Z)(3((3HYDROXYBENZOYL)AMINO)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)BENZOATE
MFCD01166019
ZINC000001834674
ZINC01834674
ZINC1834674

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Available files

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