Vitas-M small molecule compound
2-({2-ethoxy-4-[(E)-{(2Z)-2-[(4-methylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}methyl)benzonitrile
Catalog ID
STK758559
SMILES CCOc1cc(ccc1OCc1ccccc1C#N)/C=C\1/S/C(=N\c2ccc(cc2)C)/NC1=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 C27H23N3O3S MW 469.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O3S/c1-3-32-24-14-19(10-13-23(24)33-17-21-7-5-4-6-20(21)16-28)15-25-26(31)30-27(34-25)29-22-11-8-18(2)9-12-22/h4-15H,3,17H2,1-2H3,(H,29,30,31)/b25-15+InChIKey
YBYZIOXQMAEMIM-MFKUBSTISA-NSynonyms
2((2ethoxy4((E)((2Z)2((4methylphenyl)imino)4oxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzonitrile
2((2ETHOXY4((E)(2(4METHYLANILINO)4OXO13THIAZOL5YLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
CCOC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C)OCC4=CC=CC=C4C#N
CCOc1cc(ccc1OCc1ccccc1C#N)C=C1SC(=Nc2ccc(cc2)C)NC1=O
InChI=1SC27H23N3O3Sc1332241419(101323(24)331721754620(21)1628)152526(31)3027(3425)292211818(2)91222h415H317H212H3(H293031)b2515+
MFCD01459969
ZINC000003666814
ZINC03666814
ZINC3666814
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