Vitas-M small molecule compound

2-ethoxy-4-{(E)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl thiophene-2-carboxylate

Catalog ID
STK393529
SMILES C=CCN1C(=S)S/C(=C/c2ccc(c(c2)OCC)OC(=O)c2cccs2)/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 C20H17NO4S3 MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO4S3/c1-3-9-21-18(22)17(28-20(21)26)12-13-7-8-14(15(11-13)24-4-2)25-19(23)16-6-5-10-27-16/h3,5-8,10-12H,1,4,9H2,2H3/b17-12+
InChIKey
HLLVGJHZZZKKBU-SFQUDFHCSA-N
Synonyms

(2ETHOXY4((E)(4OXO3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)THIOPHENE2CARBOXYLATE
2ethoxy4((E)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)phenylthiophene2carboxylate
C=CCN1C(=S)SC(=Cc2ccc(c(c2)OCC)OC(=O)c2cccs2)C1=O
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC=C)OC(=O)C3=CC=CS3
InChI=1SC20H17NO4S3c1392118(22)17(2820(21)26)12137814(15(1113)2442)2519(23)1665102716h3581012H149H22H3b1712+
MFCD03706932
ZINC000002993291
ZINC02993291
ZINC2993291

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Available files

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