Vitas-M small molecule compound
(5Z)-5-({3-[2-methyl-5-(propan-2-yl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK823056
SMILES CC(c1ccc(c(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1)C)C
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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 C31H29N3OS2 MW 523.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3OS2/c1-21(2)24-15-14-22(3)27(18-24)29-25(20-34(32-29)26-12-8-5-9-13-26)19-28-30(35)33(31(36)37-28)17-16-23-10-6-4-7-11-23/h4-15,18-21H,16-17H2,1-3H3/b28-19-InChIKey
LJTQEHPVYWIYEB-USHMODERSA-NSynonyms
(5Z)5((3(2methyl5(propan2yl)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(2methyl5propan2ylphenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((3(2METHYL5PROPAN2YLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
CC(c1ccc(c(c1)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1)C)C
CC1=C(C=C(C=C1)C(C)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC31H29N3OS2c121(2)24151422(3)27(1824)2925(2034(3229)26128591326)192830(35)33(31(36)3728)171623106471123h4151821H1617H213H3b2819
MFCD03463618
ZINC000027018335
ZINC27018335
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