Vitas-M small molecule compound

ethyl 4-{5-[(E)-(2-{[(2-bromophenyl)(methylsulfonyl)amino]acetyl}hydrazinylidene)methyl]furan-2-yl}benzoate (non-preferred name)

Catalog ID
STL086379
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=N/NC(=O)CN(S(=O)(=O)C)c1ccccc1Br

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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 C23H22BrN3O6S MW 548.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O6S/c1-3-32-23(29)17-10-8-16(9-11-17)21-13-12-18(33-21)14-25-26-22(28)15-27(34(2,30)31)20-7-5-4-6-19(20)24/h4-14H,3,15H2,1-2H3,(H,26,28)/b25-14+
InChIKey
PVWWZPFUWTYRBC-AFUMVMLFSA-N
Synonyms

4(5((2((2BROMOPHENYL)METHANESULFONYLAMINO)ACETYL)HYDRAZONOMETHYL)FURAN2YL)BENZOICACIDETHYLESTER
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC(=O)CN(C3=CC=CC=C3Br)S(=O)(=O)C
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=NNC(=O)CN(S(=O)(=O)C)c1ccccc1Br
ETHYL4(5((1E)2(2((2BROMOPHENYL)(METHYLSULFONYL)AMINO)ACETYLAMINO)2AZAVINYL)2FURYL)BENZOATE
ETHYL4(5((E)((2(2BROMONMETHYLSULFONYLANILINO)ACETYL)HYDRAZINYLIDENE)METHYL)FURAN2YL)BENZOATE
ethyl4(5((E)(2(((2bromophenyl)(methylsulfonyl)amino)acetyl)hydrazinylidene)methyl)furan2yl)benzoate(nonpreferredname)
ETHYL4(5(2((2BROMO(METHYLSULFONYL)ANILINO)ACETYL)CARBOHYDRAZONOYL)2FURYL)BENZOATE
InChI=1SC23H22BrN3O6Sc133223(29)1710816(91117)21131218(3321)14252622(28)1527(34(230)31)20754619(20)24h414H315H212H3(H2628)b2514+
MFCD02071719
ZINC000002173133
ZINC73379241

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Available files

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