Vitas-M small molecule compound
3-({3-[(E)-{2-[2-nitro-4-(trifluoromethyl)phenyl]hydrazinylidene}methyl]-1H-indol-1-yl}methyl)benzoic acid
Catalog ID
STK201087
SMILES OC(=O)c1cccc(c1)Cn1cc(c2c1cccc2)/C=N/Nc1ccc(cc1[N+](=O)[O-])C(F)(F)F
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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 C24H17F3N4O4 MW 482.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17F3N4O4/c25-24(26,27)18-8-9-20(22(11-18)31(34)35)29-28-12-17-14-30(21-7-2-1-6-19(17)21)13-15-4-3-5-16(10-15)23(32)33/h1-12,14,29H,13H2,(H,32,33)/b28-12+InChIKey
WYJUHNODHWTFLW-KVSWJAHQSA-NSynonyms
3((3((E)((2nitro4(trifluoromethyl)phenyl)hydrazinylidene)methyl)indol1yl)methyl)benzoicacid
3((3((E)(2(2NITRO4(TRIFLUOROMETHYL)PHENYL)HYDRAZINYLIDENE)METHYL)1HINDOL1YL)METHYL)BENZOICACID
C1=CC=C2C(=C1)C(=CN2CC3=CC=CC(=C3)C(=O)O)C=NNC4=C(C=C(C=C4)C(F)(F)F)(N+)(=O)(O)
InChI=1SC24H17F3N4O4c2524(2627)188920(22(1118)31(34)35)292812171430(21721619(17)21)131543516(1015)23(32)33h1121429H13H2(H3233)b2812+
MFCD06666569
OC(=O)c1cccc(c1)Cn1cc(c2c1cccc2)C=NNc1ccc(cc1(N+)(=O)(O))C(F)(F)F
ZINC000009265322
ZINC96868615
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