Vitas-M small molecule compound

5-({(E)-[1-(4-fluorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-1,3-dihydro-2H-benzimidazol-2-one

Catalog ID
STL295620
SMILES Fc1ccc(cc1)N1N=C(/C(=C\Nc2ccc3c(c2)[nH]c(=O)[nH]3)/C1=O)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 C18H14FN5O2 MW 351.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14FN5O2/c1-10-14(17(25)24(23-10)13-5-2-11(19)3-6-13)9-20-12-4-7-15-16(8-12)22-18(26)21-15/h2-9,20H,1H3,(H2,21,22,26)/b14-9+
InChIKey
YOFPDEFRAZRDMB-NTEUORMPSA-N
Synonyms

5(((E)(1(4fluorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)13dihydro2Hbenzimidazol2one
5(((E)(1(4fluorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)13dihydrobenzimidazol2one
CC1=NN(C(=O)C1=CNC2=CC3=C(C=C2)NC(=O)N3)C4=CC=C(C=C4)F
Fc1ccc(cc1)N1N=C(C(=CNc2ccc3c(c2)(nH)c(=O)(nH)3)C1=O)C
InChI=1SC18H14FN5O2c11014(17(25)24(2310)135211(19)3613)92012471516(812)2218(26)2115h2920H1H3(H2212226)b149+
MFCD28033058
ZINC000101113871
ZINC101113871

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Available files

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