Vitas-M small molecule compound
1,4-dimethyl-6-(4-methylpiperidin-1-yl)-2-oxo-5-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STL237018
SMILES C=CCN1C(=S)S/C(=C\c2c(N3CCC(CC3)C)n(C)c(=O)c(c2C)C#N)/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 C21H24N4O2S2 MW 428.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S2/c1-5-8-25-20(27)17(29-21(25)28)11-15-14(3)16(12-22)19(26)23(4)18(15)24-9-6-13(2)7-10-24/h5,11,13H,1,6-10H2,2-4H3/b17-11-InChIKey
MNDAOMDACPYEAR-BOPFTXTBSA-NSynonyms
620154-80-5(Z)5((3allyl4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl6(4methylpiperidin1yl)2oxo12dihydropyridine3carbonitrile
14dimethyl6(4methylpiperidin1yl)2oxo5((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)12dihydropyridine3carbonitrile
14DIMETHYL6(4METHYLPIPERIDIN1YL)2OXO5((Z)(4OXO3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDINE3CARBONITRILE
620154805
C=CCN1C(=S)SC(=Cc2c(N3CCC(CC3)C)n(C)c(=O)c(c2C)C#N)C1=O
CC1CCN(CC1)C2=C(C(=C(C(=O)N2C)C#N)C)C=C3C(=O)N(C(=S)S3)CC=C
InChI=1SC21H24N4O2S2c1582520(27)17(2921(25)28)111514(3)16(1222)19(26)23(4)18(15)249613(2)71024h51113H1610H224H3b1711
MFCD03690234
ZINC000002251219
ZINC02251219
ZINC2251219
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