Vitas-M small molecule compound
(5Z)-1-(3-bromophenyl)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK197096
SMILES Brc1cccc(c1)N1C(=S)NC(=O)/C(=C/c2cc(n(c2C)c2ccccc2)C)/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 C23H18BrN3O2S MW 480.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O2S/c1-14-11-16(15(2)26(14)18-8-4-3-5-9-18)12-20-21(28)25-23(30)27(22(20)29)19-10-6-7-17(24)13-19/h3-13H,1-2H3,(H,25,28,30)/b20-12-InChIKey
PAGLNMVFJDQKIF-NDENLUEZSA-NSynonyms
(5Z)1(3BROMOPHENYL)5((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5Z)1(3bromophenyl)5((25dimethyl1phenylpyrrol3yl)methylidene)2sulfanylidene13diazinane46dione
Brc1cccc(c1)N1C(=S)NC(=O)C(=Cc2cc(n(c2C)c2ccccc2)C)C1=O
CC1=CC(=C(N1C2=CC=CC=C2)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)Br
InChI=1SC23H18BrN3O2Sc1141116(15(2)26(14)188435918)122021(28)2523(30)27(22(20)29)19106717(24)1319h313H12H3(H252830)b2012
MFCD05041172
ZINC000009934453
ZINC09934453
ZINC9934453
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