Vitas-M small molecule compound
(6E)-6-{3-bromo-4-[(3-methylbenzyl)oxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK055402
SMILES Cc1cccc(c1)COc1ccc(cc1Br)/C=C\1/C(=O)N=c2n(C1=N)ncs2
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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 C20H15BrN4O2S MW 455.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrN4O2S/c1-12-3-2-4-14(7-12)10-27-17-6-5-13(9-16(17)21)8-15-18(22)25-20(24-19(15)26)28-11-23-25/h2-9,11,22H,10H2,1H3/b15-8+,22-18-InChIKey
DFMZZFBSWMLJRC-QAHVJKHLSA-NSynonyms
(6E)6(3bromo4((3methylbenzyl)oxy)benzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
Cc1cccc(c1)COc1ccc(cc1Br)C=C1C(=O)N=c2n(C1=N)ncs2
MFCD05977380
STK055402
ZINC000013944076
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