Vitas-M small molecule compound
5-({(E)-[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL294894
SMILES Clc1cccc(c1)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 C18H14ClN5O2 MW 367.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClN5O2/c1-10-14(17(25)24(23-10)13-4-2-3-11(19)7-13)9-20-12-5-6-15-16(8-12)22-18(26)21-15/h2-9,20H,1H3,(H2,21,22,26)/b14-9+InChIKey
RAOYKCHUHYUBRX-NTEUORMPSA-NSynonyms
5(((E)(1(3chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)13dihydro2Hbenzimidazol2one
5(((E)(1(3chlorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)13dihydrobenzimidazol2one
CC1=NN(C(=O)C1=CNC2=CC3=C(C=C2)NC(=O)N3)C4=CC(=CC=C4)Cl
Clc1cccc(c1)N1N=C(C(=CNc2ccc3c(c2)(nH)c(=O)(nH)3)C1=O)C
InChI=1SC18H14ClN5O2c11014(17(25)24(2310)1342311(19)713)92012561516(812)2218(26)2115h2920H1H3(H2212226)b149+
MFCD28032812
ZINC000101125179
ZINC101125179
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