Vitas-M small molecule compound

(5Z)-5-({3-[2-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK594800
SMILES CC(Oc1ccc(c(c1)C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1)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 C31H29N3O2S2 MW 539.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O2S2/c1-21(2)36-26-14-15-27(22(3)18-26)29-24(20-34(32-29)25-12-8-5-9-13-25)19-28-30(35)33(31(37)38-28)17-16-23-10-6-4-7-11-23/h4-15,18-21H,16-17H2,1-3H3/b28-19-
InChIKey
SAYHXBXNNCDNLO-USHMODERSA-N
Synonyms
956297-84-0
(5Z)5((3(2methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(2methyl4propan2yloxyphenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((3(2METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4isopropoxy2methylphenyl)1phenyl1Hpyrazol4yl)methylene)3phenethyl2thioxothiazolidin4one
956297840
CC(Oc1ccc(c(c1)C)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1)C
CC1=C(C=CC(=C1)OC(C)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC31H29N3O2S2c121(2)3626141527(22(3)1826)2924(2034(3229)25128591325)192830(35)33(31(37)3828)171623106471123h4151821H1617H213H3b2819
MFCD03668382
ZINC000100959073
ZINC100959073

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Available files

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