Vitas-M small molecule compound

1,3-bis(2-methylphenyl)-5-[4-(propan-2-yloxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STL005564
SMILES CC(Oc1ccc(cc1)/C=C/1\C(=O)N(c2ccccc2C)C(=S)N(C1=O)c1ccccc1C)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 C28H26N2O3S MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O3S/c1-18(2)33-22-15-13-21(14-16-22)17-23-26(31)29(24-11-7-5-9-19(24)3)28(34)30(27(23)32)25-12-8-6-10-20(25)4/h5-18H,1-4H3
InChIKey
GAHQXFXVUGPTHR-UHFFFAOYSA-N
Synonyms
899413-11-7
13BIS(2METHYLPHENYL)5((4PROPAN2YLOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
13bis(2methylphenyl)5(4(propan2yloxy)benzylidene)2thioxodihydropyrimidine46(1H5H)dione
5(4isopropoxybenzylidene)2thioxo13diotolyldihydropyrimidine46(1H5H)dione
899413117
CC(Oc1ccc(cc1)C=C1C(=O)N(c2ccccc2C)C(=S)N(C1=O)c1ccccc1C)C
CC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(C=C3)OC(C)C)C(=O)N(C2=S)C4=CC=CC=C4C
InChI=1SC28H26N2O3Sc118(2)3322151321(141622)172326(31)29(241175919(24)3)28(34)30(27(23)32)2512861020(25)4h518H14H3
MFCD06605265
ZINC000002324081
ZINC02324081
ZINC2324081

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Available files

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