Vitas-M small molecule compound
(5Z)-5-{[3-(3-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK707119
SMILES CCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C)c1ccccc1
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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 C29H25N3O2S2 MW 511.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O2S2/c1-3-34-25-16-10-13-22(17-25)27-23(19-31(30-27)24-14-8-5-9-15-24)18-26-28(33)32(29(35)36-26)20(2)21-11-6-4-7-12-21/h4-20H,3H2,1-2H3/b26-18-InChIKey
PDSKTXSBFGTOID-ITYLOYPMSA-NSynonyms
1009437-28-8(5Z)5((3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(1phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(3ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)methylene)3(1phenylethyl)2thioxothiazolidin4one
1009437288
CCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)C5=CC=CC=C5
CCOc1cccc(c1)c1nn(cc1C=C1SC(=S)N(C1=O)C(c1ccccc1)C)c1ccccc1
InChI=1SC29H25N3O2S2c13342516101322(1725)2723(1931(3027)24148591524)182628(33)32(29(35)3626)20(2)21116471221h420H3H212H3b2618
MFCD04015068
ZINC000002427647
ZINC000002427648
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