Vitas-M small molecule compound

2-{(E)-[2-({[2-chloro-5-(trifluoromethyl)phenyl](phenylsulfonyl)amino}acetyl)hydrazinylidene]methyl}benzoic acid (non-preferred name)

Catalog ID
STL113837
SMILES O=C(CN(S(=O)(=O)c1ccccc1)c1cc(ccc1Cl)C(F)(F)F)N/N=C/c1ccccc1C(=O)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 C23H17ClF3N3O5S MW 539.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClF3N3O5S/c24-19-11-10-16(23(25,26)27)12-20(19)30(36(34,35)17-7-2-1-3-8-17)14-21(31)29-28-13-15-6-4-5-9-18(15)22(32)33/h1-13H,14H2,(H,29,31)(H,32,33)/b28-13+
InChIKey
WKMQIHWBZXTROZ-XODNFHPESA-N
Synonyms

2((1E)2(2((2CHLORO5(TRIFLUOROMETHYL)PHENYL)(PHENYLSULFONYL)AMINO)ACETYLAMINO)2AZAVINYL)BENZOICACID
2((E)((2(N(benzenesulfonyl)2chloro5(trifluoromethyl)anilino)acetyl)hydrazinylidene)methyl)benzoicacid
2((E)(2(((2chloro5(trifluoromethyl)phenyl)(phenylsulfonyl)amino)acetyl)hydrazinylidene)methyl)benzoicacid(nonpreferredname)
C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NN=CC2=CC=CC=C2C(=O)O)C3=C(C=CC(=C3)C(F)(F)F)Cl
InChI=1SC23H17ClF3N3O5Sc2419111016(23(2526)27)1220(19)30(36(3435)177213817)1421(31)29281315645918(15)22(32)33h113H14H2(H2931)(H3233)b2813+
MFCD03556970
O=C(CN(S(=O)(=O)c1ccccc1)c1cc(ccc1Cl)C(F)(F)F)NN=Cc1ccccc1C(=O)O
ZINC000059652493
ZINC103143434

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Available files

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