Vitas-M small molecule compound
ethyl 1-(4-bromophenyl)-8-(4-ethylphenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7,9-triene-3-carboxylate
Catalog ID
STK537409
SMILES CCOC(=O)C1=NN(C2(S1)C=CC(=NN2c1ccccc1)c1ccc(cc1)CC)c1ccc(cc1)Br
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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 C28H25BrN4O2S MW 561.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25BrN4O2S/c1-3-20-10-12-21(13-11-20)25-18-19-28(32(30-25)23-8-6-5-7-9-23)33(24-16-14-22(29)15-17-24)31-26(36-28)27(34)35-4-2/h5-19H,3-4H2,1-2H3InChIKey
AWRVAYJJAHBWJR-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2=NN(C3(C=C2)N(N=C(S3)C(=O)OCC)C4=CC=C(C=C4)Br)C5=CC=CC=C5
ethyl1(4bromophenyl)8(4ethylphenyl)6phenyl4thia1267tetraazaspiro(45)deca279triene3carboxylate
ethyl4(4bromophenyl)8(4ethylphenyl)10phenyl1thia34910tetrazaspiro(45)deca268triene2carboxylate
InChI=1SC28H25BrN4O2Sc1320101221(131120)25181928(32(3025)238657923)33(24161422(29)151724)3126(3628)27(34)3542h519H34H212H3
MFCD02986801
ZINC000102420714
ZINC000102420718
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