Vitas-M small molecule compound

(5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK191586
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2cc3OCOc3cc2Br)/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 C15H11BrN2O4S MW 395.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrN2O4S/c1-2-3-18-14(20)9(13(19)17-15(18)23)4-8-5-11-12(6-10(8)16)22-7-21-11/h2,4-6H,1,3,7H2,(H,17,19,23)/b9-4+
InChIKey
HNAUBMBVHGGRJT-RUDMXATFSA-N
Synonyms
347393-85-5
(5E)5((6BROMO13BENZODIOXOL5YL)METHYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)5((6BROMO13BENZODIOXOL5YL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
1ALLYL5((6BROMO13BENZODIOXOL5YL)METHYLENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
C=CCN1C(=O)C(=CC2=CC3=C(C=C2Br)OCO3)C(=O)NC1=S
C=CCN1C(=S)NC(=O)C(=Cc2cc3OCOc3cc2Br)C1=O
Registry IDs
MFCD02379539
ZINC000000670028
ZINC00670028
ZINC670028

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Available files

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