Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL375587
SMILES Brc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2cccn2C)/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 C16H12BrN3O2S MW 390.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrN3O2S/c1-19-8-2-3-12(19)9-13-14(21)18-16(23)20(15(13)22)11-6-4-10(17)5-7-11/h2-9H,1H3,(H,18,21,23)/b13-9+InChIKey
UTAQJXZNLLVRFC-UKTHLTGXSA-NSynonyms
(5E)1(4bromophenyl)5((1methyl1Hpyrrol2yl)methylidene)2thioxodihydropyrimidine46(1H5H)dione
(5E)1(4BROMOPHENYL)5((1METHYLPYRROL2YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
Brc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2cccn2C)C1=O
CN1C=CC=C1C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Br
InChI=1SC16H12BrN3O2Sc11982312(19)91314(21)1816(23)20(15(13)22)116410(17)5711h29H1H3(H182123)b139+
MFCD05128870
ZINC000001162869
ZINC1162869
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