Vitas-M small molecule compound

2-{[1-(2,4-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}pyridine-3-carboxylic acid

Catalog ID
STL020588
SMILES Cc1ccc(c(c1)C)N1C(=O)CC(C1=O)Sc1ncccc1C(=O)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 C18H16N2O4S MW 356.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O4S/c1-10-5-6-13(11(2)8-10)20-15(21)9-14(17(20)22)25-16-12(18(23)24)4-3-7-19-16/h3-8,14H,9H2,1-2H3,(H,23,24)
InChIKey
BCDKCERGWIBYHV-UHFFFAOYSA-N
Synonyms
838890-47-4
2(((3R)1(24DIMETHYLPHENYL)25DIOXOPYRROLIDIN3YL)SULFANYL)PYRIDINE3CARBOXYLICACID
2((1(24dimethylphenyl)25dioxopyrrolidin3yl)sulfanyl)pyridine3carboxylicacid
2((1(24DIMETHYLPHENYL)25DIOXOPYRROLIDIN3YL)THIO)NICOTINICACID
2(1(24DIMETHYLPHENYL)25DIOXOAZOLIDIN3YLTHIO)PYRIDINE3CARBOXYLICACID
2(1(24DIMETHYLPHENYL)25DIOXOPYRROLIDIN3YL)SULFANYLPYRIDINE3CARBOXYLICACID
838890474
CC1=CC(=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C=CC=N3)C(=O)O)C
InChI=1SC18H16N2O4Sc1105613(11(2)810)2015(21)914(17(20)22)251612(18(23)24)4371916h3814H9H212H3(H2324)
MFCD06420398
ZINC000002890044
ZINC000019881454

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Available files

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