Vitas-M small molecule compound

N-{1-[(2E)-2-({2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)hydrazinyl]-1-oxopropan-2-yl}-N-(4-methoxyphenyl)methanesulfonamide (non-preferred name)

Catalog ID
STK915829
SMILES COc1ccc(cc1)N(S(=O)(=O)C)C(C(=O)N/N=C/c1cc(n(c1C)c1ccccc1C(F)(F)F)C)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 C25H27F3N4O4S MW 536.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27F3N4O4S/c1-16-14-19(17(2)31(16)23-9-7-6-8-22(23)25(26,27)28)15-29-30-24(33)18(3)32(37(5,34)35)20-10-12-21(36-4)13-11-20/h6-15,18H,1-5H3,(H,30,33)/b29-15+
InChIKey
IAGBYRJEHSXGCA-WKULSOCRSA-N
Synonyms

CC1=CC(=C(N1C2=CC=CC=C2C(F)(F)F)C)C=NNC(=O)C(C)N(C3=CC=C(C=C3)OC)S(=O)(=O)C
COc1ccc(cc1)N(S(=O)(=O)C)C(C(=O)NN=Cc1cc(n(c1C)c1ccccc1C(F)(F)F)C)C
InChI=1SC25H27F3N4O4Sc1161419(17(2)31(16)23976822(23)25(2627)28)15293024(33)18(3)32(37(534)35)20101221(364)131120h61518H15H3(H3033)b2915+
MFCD02052736
N((E)(25DIMETHYL1(2(TRIFLUOROMETHYL)PHENYL)PYRROL3YL)METHYLIDENEAMINO)2(4METHOXYNMETHYLSULFONYLANILINO)PROPANAMIDE
N(1((2E)2((25dimethyl1(2(trifluoromethyl)phenyl)1Hpyrrol3yl)methylidene)hydrazinyl)1oxopropan2yl)N(4methoxyphenyl)methanesulfonamide(nonpreferredname)
ZINC000059832378
ZINC000059832382

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Available files

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