Vitas-M small molecule compound
(5Z)-5-{[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK706503
SMILES CCCOc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CC=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 C26H25N3O2S2 MW 475.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S2/c1-4-13-28-25(30)23(33-26(28)32)16-20-17-29(21-9-7-6-8-10-21)27-24(20)19-11-12-22(18(3)15-19)31-14-5-2/h4,6-12,15-17H,1,5,13-14H2,2-3H3/b23-16-InChIKey
IGAFYETVXDWIRK-KQWNVCNZSA-NSynonyms
(5Z)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((3(3METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3allyl5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC=C)C4=CC=CC=C4)C
CCCOc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)CC=C)c1ccccc1
InChI=1SC26H25N3O2S2c14132825(30)23(3326(28)32)16201729(2197681021)2724(20)19111222(18(3)1519)311452h46121517H151314H223H3b2316
MFCD02996081
ZINC000002304688
ZINC02304688
ZINC2304688
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