Vitas-M small molecule compound
(5Z)-5-{[3-(1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-heptyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK880770
SMILES CCCCCCCN1C(=S)S/C(=C\c2cn(nc2c2nc3c(s2)cccc3)c2ccccc2)/C1=O
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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 C27H26N4OS3 MW 518.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4OS3/c1-2-3-4-5-11-16-30-26(32)23(35-27(30)33)17-19-18-31(20-12-7-6-8-13-20)29-24(19)25-28-21-14-9-10-15-22(21)34-25/h6-10,12-15,17-18H,2-5,11,16H2,1H3/b23-17-InChIKey
MYLQSBJIDNBSGL-QJOMJCCJSA-NSynonyms
956201-48-2(5Z)5((3(13benzothiazol2yl)1phenyl1Hpyrazol4yl)methylidene)3heptyl2thioxo13thiazolidin4one
(5Z)5((3(13BENZOTHIAZOL2YL)1PHENYLPYRAZOL4YL)METHYLIDENE)3HEPTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
956201482
CCCCCCCN1C(=O)C(=CC2=CN(N=C2C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)SC1=S
CCCCCCCN1C(=S)SC(=Cc2cn(nc2c2nc3c(s2)cccc3)c2ccccc2)C1=O
InChI=1SC27H26N4OS3c1234511163026(32)23(3527(30)33)17191831(20127681320)2924(19)252821149101522(21)3425h61012151718H251116H21H3b2317
MFCD04441343
ZINC000002695233
ZINC2695233
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