Vitas-M small molecule compound
(5E)-5-{[1-(4-bromophenyl)-1H-pyrrol-2-yl]methylidene}-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK008984
SMILES Brc1ccc(cc1)n1cccc1/C=C/1\C(=O)NC(=S)N(C1=O)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 C16H12BrN3O2S MW 390.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrN3O2S/c1-19-15(22)13(14(21)18-16(19)23)9-12-3-2-8-20(12)11-6-4-10(17)5-7-11/h2-9H,1H3,(H,18,21,23)/b13-9+InChIKey
SLAXZYIFXQWCAZ-UKTHLTGXSA-NSynonyms
(5E)5((1(4BROMOPHENYL)1HPYRROL2YL)METHYLIDENE)1METHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)5((1(4BROMOPHENYL)PYRROL2YL)METHYLIDENE)1METHYL2SULFANYLIDENE13DIAZINANE46DIONE
Brc1ccc(cc1)n1cccc1C=C1C(=O)NC(=S)N(C1=O)C
CN1C(=O)C(=CC2=CC=CN2C3=CC=C(C=C3)Br)C(=O)NC1=S
InChI=1SC16H12BrN3O2Sc11915(22)13(14(21)1816(19)23)91232820(12)116410(17)5711h29H1H3(H182123)b139+
MFCD03228493
STK008984
ZINC000004550932
ZINC04550932
ZINC4550932
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