Vitas-M small molecule compound
(5Z)-5-({3-[4-(3-methylbutoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702977
SMILES CC(CCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C)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 C32H31N3O2S2 MW 553.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O2S2/c1-22(2)18-19-37-28-16-14-25(15-17-28)30-26(21-34(33-30)27-12-8-5-9-13-27)20-29-31(36)35(32(38)39-29)23(3)24-10-6-4-7-11-24/h4-17,20-23H,18-19H2,1-3H3/b29-20-InChIKey
LGJLJMJKJDNPMB-BRPDVVIDSA-NSynonyms
(5Z)5((3(4(3methylbutoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(1phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(4(3METHYLBUTOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4(isopentyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)3(1phenylethyl)2thioxothiazolidin4one
CC(C)CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)C5=CC=CC=C5
CC(CCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)C(c1ccccc1)C)c1ccccc1)C
InChI=1SC32H31N3O2S2c122(2)18193728161425(151728)3026(2134(3330)27128591327)202931(36)35(32(38)3929)23(3)24106471124h4172023H1819H213H3b2920
MFCD02997947
ZINC000100838068
ZINC000100838069
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