Vitas-M small molecule compound
methyl 8-(4-bromophenyl)-1-(3-chlorophenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7,9-triene-3-carboxylate
Catalog ID
STL050989
SMILES COC(=O)C1=NN(C2(S1)C=CC(=NN2c1ccccc1)c1ccc(cc1)Br)c1cccc(c1)Cl
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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 C25H18BrClN4O2S MW 553.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18BrClN4O2S/c1-33-24(32)23-29-31(21-9-5-6-19(27)16-21)25(34-23)15-14-22(17-10-12-18(26)13-11-17)28-30(25)20-7-3-2-4-8-20/h2-16H,1H3InChIKey
LJXNVAMCVHSBLI-UHFFFAOYSA-NSynonyms
COC(=O)C1=NN(C2(S1)C=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Br)C5=CC(=CC=C5)Cl
InChI=1SC25H18BrClN4O2Sc13324(32)232931(2195619(27)1621)25(3423)151422(17101218(26)131117)2830(25)207324820h216H1H3
methyl8(4bromophenyl)1(3chlorophenyl)6phenyl4thia1267tetraazaspiro(45)deca279triene3carboxylate
methyl8(4bromophenyl)4(3chlorophenyl)10phenyl1thia34910tetrazaspiro(45)deca268triene2carboxylate
MFCD03672625
ZINC000102888271
ZINC000102888273
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