Vitas-M small molecule compound
2-({(5E)-5-[(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzonitrile
Catalog ID
STK201352
SMILES N#Cc1ccccc1CN1C(=O)S/C(=C/c2cc(n(c2C)CC)C)/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 C20H19N3O2S MW 365.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O2S/c1-4-22-13(2)9-17(14(22)3)10-18-19(24)23(20(25)26-18)12-16-8-6-5-7-15(16)11-21/h5-10H,4,12H2,1-3H3/b18-10+InChIKey
WOMTWVGWCQKWCG-VCHYOVAHSA-NSynonyms
2(((5E)5((1ETHYL25DIMETHYL1HPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)METHYL)BENZONITRILE
2(((5E)5((1ETHYL25DIMETHYLPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)METHYL)BENZONITRILE
CCN1C(=CC(=C1C)C=C2C(=O)N(C(=O)S2)CC3=CC=CC=C3C#N)C
InChI=1SC20H19N3O2Sc142213(2)917(14(22)3)101819(24)23(20(25)2618)1216865715(16)1121h510H412H213H3b1810+
MFCD04318735
N#Cc1ccccc1CN1C(=O)SC(=Cc2cc(n(c2C)CC)C)C1=O
ZINC000004739712
ZINC04739712
ZINC4739712
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