Vitas-M small molecule compound
2-(2,5-dimethyl-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1H-pyrrol-1-yl)-4,5-dimethylthiophene-3-carbonitrile
Catalog ID
STK118608
SMILES C=CCN1C(=S)S/C(=C\c2cc(n(c2C)c2sc(c(c2C#N)C)C)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 C20H19N3OS3 MW 413.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3OS3/c1-6-7-22-18(24)17(27-20(22)25)9-15-8-11(2)23(13(15)4)19-16(10-21)12(3)14(5)26-19/h6,8-9H,1,7H2,2-5H3/b17-9-InChIKey
LSPOLEMQZAQRBE-MFOYZWKCSA-NSynonyms
2(25DIMETHYL3((Z)(4OXO3(PROP2EN1YL)2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)1HPYRROL1YL)45DIMETHYLTHIOPHENE3CARBONITRILE
2(25DIMETHYL3((Z)(4OXO3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRROL1YL)45DIMETHYLTHIOPHENE3CARBONITRILE
C=CCN1C(=S)SC(=Cc2cc(n(c2C)c2sc(c(c2C#N)C)C)C)C1=O
CC1=CC(=C(N1C2=C(C(=C(S2)C)C)C#N)C)C=C3C(=O)N(C(=S)S3)CC=C
InChI=1SC20H19N3OS3c1672218(24)17(2720(22)25)915811(2)23(13(15)4)1916(1021)12(3)14(5)2619h689H17H225H3b179
MFCD04000774
ZINC000012629551
ZINC12629551
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