Vitas-M small molecule compound
1-(5-cyano-1,4-dimethyl-6-oxo-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,6-dihydropyridin-2-yl)piperidine-4-carboxamide
Catalog ID
STK882972
SMILES N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCc2ccccc2)c(n(c1=O)C)N1CCC(CC1)C(=O)N
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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 C26H27N5O3S2 MW 521.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3S2/c1-16-19(14-21-25(34)31(26(35)36-21)13-8-17-6-4-3-5-7-17)23(29(2)24(33)20(16)15-27)30-11-9-18(10-12-30)22(28)32/h3-7,14,18H,8-13H2,1-2H3,(H2,28,32)/b21-14-InChIKey
JGWQWPZMZWRVKF-STZFKDTASA-NSynonyms
1(5cyano14dimethyl6oxo3((Z)(4oxo3(2phenylethyl)2sulfanylidene13thiazolidin5ylidene)methyl)pyridin2yl)piperidine4carboxamide
1(5cyano14dimethyl6oxo3((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)16dihydropyridin2yl)piperidine4carboxamide
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC=CC=C3)N4CCC(CC4)C(=O)N)C)C#N
InChI=1SC26H27N5O3S2c11619(142125(34)31(26(35)3621)138176435717)23(29(2)24(33)20(16)1527)3011918(101230)22(28)32h371418H813H212H3(H22832)b2114
MFCD06646564
N#Cc1c(C)c(C=C2SC(=S)N(C2=O)CCc2ccccc2)c(n(c1=O)C)N1CCC(CC1)C(=O)N
ZINC000016750095
ZINC16750095
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