Vitas-M small molecule compound

2-{[(5E)-5-(3,4-dihydroxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]methyl}benzonitrile

Catalog ID
STK121802
SMILES N#Cc1ccccc1CN1C(=O)S/C(=C/c2ccc(c(c2)O)O)/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 C18H12N2O4S MW 352.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N2O4S/c19-9-12-3-1-2-4-13(12)10-20-17(23)16(25-18(20)24)8-11-5-6-14(21)15(22)7-11/h1-8,21-22H,10H2/b16-8+
InChIKey
CCKRVWBBMWKMMM-LZYBPNLTSA-N
Synonyms

2(((5E)5((34DIHYDROXYPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)METHYL)BENZONITRILE
2(((5E)5(34DIHYDROXYBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)METHYL)BENZONITRILE
C1=CC=C(C(=C1)CN2C(=O)C(=CC3=CC(=C(C=C3)O)O)SC2=O)C#N
InChI=1SC18H12N2O4Sc19912312413(12)102017(23)16(2518(20)24)8115614(21)15(22)711h182122H10H2b168+
MFCD04128907
N#Cc1ccccc1CN1C(=O)SC(=Cc2ccc(c(c2)O)O)C1=O
ZINC000004698809
ZINC04698809
ZINC4698809

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Available files

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