Vitas-M small molecule compound
4-methyl-2-{(5E)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}pentanoic acid
Catalog ID
STL231807
SMILES CC(CC(N1C(=S)S/C(=C/c2cccn2C)/C1=O)C(=O)O)C
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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 C15H18N2O3S2 MW 338.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O3S2/c1-9(2)7-11(14(19)20)17-13(18)12(22-15(17)21)8-10-5-4-6-16(10)3/h4-6,8-9,11H,7H2,1-3H3,(H,19,20)/b12-8+InChIKey
BVULSQXCOXUJCA-XYOKQWHBSA-NSynonyms
4methyl2((5E)5((1methyl1Hpyrrol2yl)methylidene)4oxo2thioxo13thiazolidin3yl)pentanoicacid
4METHYL2((5E)5((1METHYLPYRROL2YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PENTANOICACID
CC(C)CC(C(=O)O)N1C(=O)C(=CC2=CC=CN2C)SC1=S
CC(CC(N1C(=S)SC(=Cc2cccn2C)C1=O)C(=O)O)C
InChI=1SC15H18N2O3S2c19(2)711(14(19)20)1713(18)12(2215(17)21)81054616(10)3h468911H7H213H3(H1920)b128+
MFCD06737363
ZINC000005371644
ZINC000005371647
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