Vitas-M small molecule compound

2-({2-methoxy-4-[(Z)-(5-oxo-1-phenyl-2-thioxoimidazolidin-4-ylidene)methyl]-6-(prop-2-en-1-yl)phenoxy}methyl)benzonitrile

Catalog ID
STL368973
SMILES C=CCc1cc(cc(c1OCc1ccccc1C#N)OC)/C=C/1\NC(=S)N(C1=O)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 C28H23N3O3S MW 481.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O3S/c1-3-9-20-14-19(15-24-27(32)31(28(35)30-24)23-12-5-4-6-13-23)16-25(33-2)26(20)34-18-22-11-8-7-10-21(22)17-29/h3-8,10-16H,1,9,18H2,2H3,(H,30,35)/b24-15-
InChIKey
QWTFULRRQZEIBQ-IWIPYMOSSA-N
Synonyms

2((2ALLYL6METHOXY4((5OXO1PHENYL2THIOXO4IMIDAZOLIDINYLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
2((2METHOXY4((Z)(5OXO1PHENYL2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)6PROP2ENYLPHENOXY)METHYL)BENZONITRILE
2((2methoxy4((Z)(5oxo1phenyl2thioxoimidazolidin4ylidene)methyl)6(prop2en1yl)phenoxy)methyl)benzonitrile
C=CCc1cc(cc(c1OCc1ccccc1C#N)OC)C=C1NC(=S)N(C1=O)c1ccccc1
COC1=CC(=CC(=C1OCC2=CC=CC=C2C#N)CC=C)C=C3C(=O)N(C(=S)N3)C4=CC=CC=C4
InChI=1SC28H23N3O3Sc139201419(152427(32)31(28(35)3024)23125461323)1625(332)26(20)34182211871021(22)1729h381016H1918H22H3(H3035)b2415
MFCD03082525
ZINC000000683546
ZINC00683546
ZINC683546

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Available files

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