Vitas-M small molecule compound
(5Z)-3-(butan-2-yl)-5-({3-[4-(naphthalen-1-ylmethoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK823892
SMILES CCC(N1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OCc2cccc3c2cccc3)c2ccccc2)/C1=O)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 C34H29N3O2S2 MW 575.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H29N3O2S2/c1-3-23(2)37-33(38)31(41-34(37)40)20-27-21-36(28-13-5-4-6-14-28)35-32(27)25-16-18-29(19-17-25)39-22-26-12-9-11-24-10-7-8-15-30(24)26/h4-21,23H,3,22H2,1-2H3/b31-20-InChIKey
RPFCRDGTYQBHLR-GTWSWNCMSA-NSynonyms
(5Z)3(butan2yl)5((3(4(naphthalen1ylmethoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3butan2yl5((3(4(naphthalen1ylmethoxy)phenyl)1phenylpyrazol4yl)methylidene)2sulfanylidene13thiazolidin4one
CCC(C)N1C(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC5=CC=CC=C54)C6=CC=CC=C6)SC1=S
CCC(N1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)OCc2cccc3c2cccc3)c2ccccc2)C1=O)C
InChI=1SC34H29N3O2S2c1323(2)3733(38)31(4134(37)40)20272136(28135461428)3532(27)25161829(191725)392226129112410781530(24)26h42123H322H212H3b3120
MFCD18075756
ZINC000097947218
ZINC000097947219
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