Vitas-M small molecule compound

(5E)-5-[3-bromo-5-methoxy-4-(propan-2-yloxy)benzylidene]-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK084400
SMILES COc1cc(/C=C/2\C(=O)NC(=S)N(C2=O)C)cc(c1OC(C)C)Br

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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 C16H17BrN2O4S MW 413.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrN2O4S/c1-8(2)23-13-11(17)6-9(7-12(13)22-4)5-10-14(20)18-16(24)19(3)15(10)21/h5-8H,1-4H3,(H,18,20,24)/b10-5+
InChIKey
ZADYGTRGMFDQGB-BJMVGYQFSA-N
Synonyms

(5E)5((3BROMO5METHOXY4PROPAN2YLOXYPHENYL)METHYLIDENE)1METHYL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(3BROMO5METHOXY4(PROPAN2YLOXY)BENZYLIDENE)1METHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CC(C)OC1=C(C=C(C=C1Br)C=C2C(=O)NC(=S)N(C2=O)C)OC
COc1cc(C=C2C(=O)NC(=S)N(C2=O)C)cc(c1OC(C)C)Br
InChI=1SC16H17BrN2O4Sc18(2)231311(17)69(712(13)224)51014(20)1816(24)19(3)15(10)21h58H14H3(H182024)b105+
MFCD03228476
STK084400
ZINC000004672505
ZINC04672505
ZINC4672505

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Available files

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