Vitas-M small molecule compound
N-(4-{[(2E)-2-({2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)hydrazinyl]carbonyl}benzyl)-N-phenylmethanesulfonamide
Catalog ID
STK977301
SMILES O=C(c1ccc(cc1)CN(S(=O)(=O)C)c1ccccc1)N/N=C/c1cc(n(c1C)c1ccccc1C(F)(F)F)C
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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 C29H27F3N4O3S MW 568.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27F3N4O3S/c1-20-17-24(21(2)36(20)27-12-8-7-11-26(27)29(30,31)32)18-33-34-28(37)23-15-13-22(14-16-23)19-35(40(3,38)39)25-9-5-4-6-10-25/h4-18H,19H2,1-3H3,(H,34,37)/b33-18+InChIKey
VYDOZGYPYOMBMX-DPNNOFEESA-NSynonyms
CC1=CC(=C(N1C2=CC=CC=C2C(F)(F)F)C)C=NNC(=O)C3=CC=C(C=C3)CN(C4=CC=CC=C4)S(=O)(=O)C
InChI=1SC29H27F3N4O3Sc1201724(21(2)36(20)2712871126(27)29(3031)32)18333428(37)23151322(141623)1935(40(338)39)2595461025h418H19H213H3(H3437)b3318+
MFCD02045082
N((E)(25dimethyl1(2(trifluoromethyl)phenyl)pyrrol3yl)methylideneamino)4((Nmethylsulfonylanilino)methyl)benzamide
N(4(((2E)2((25dimethyl1(2(trifluoromethyl)phenyl)1Hpyrrol3yl)methylidene)hydrazinyl)carbonyl)benzyl)Nphenylmethanesulfonamide
O=C(c1ccc(cc1)CN(S(=O)(=O)C)c1ccccc1)NN=Cc1cc(n(c1C)c1ccccc1C(F)(F)F)C
ZINC000006177848
ZINC33353488
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