Vitas-M small molecule compound
2-({3-[(E)-{(2Z)-2-[(4-ethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-2-methyl-1H-indol-1-yl}methyl)benzonitrile
Catalog ID
STK153083
SMILES CCc1ccc(cc1)/N=C\1/NC(=O)/C(=C\c2c(C)n(c3c2cccc3)Cc2ccccc2C#N)/S1
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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 C29H24N4OS MW 476.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4OS/c1-3-20-12-14-23(15-13-20)31-29-32-28(34)27(35-29)16-25-19(2)33(26-11-7-6-10-24(25)26)18-22-9-5-4-8-21(22)17-30/h4-16H,3,18H2,1-2H3,(H,31,32,34)/b27-16+InChIKey
QDKPNRBUPFORAV-JVWAILMASA-NSynonyms
2((3((E)((2Z)2((4ETHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)2METHYL1HINDOL1YL)METHYL)BENZONITRILE
2((3((E)(2(4ethylanilino)4oxo13thiazol5ylidene)methyl)2methylindol1yl)methyl)benzonitrile
CCC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=C(N(C4=CC=CC=C43)CC5=CC=CC=C5C#N)C)S2
CCc1ccc(cc1)N=C1NC(=O)C(=Cc2c(C)n(c3c2cccc3)Cc2ccccc2C#N)S1
InChI=1SC29H24N4OSc1320121423(151320)31293228(34)27(3529)162519(2)33(2611761024(25)26)1822954821(22)1730h416H318H212H3(H313234)b2716+
MFCD04358558
ZINC000009264552
ZINC09264552
ZINC9264552
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