Vitas-M small molecule compound
ethyl 3-{4-cyano-3-methyl-1-[4-(4-methylphenyl)piperazin-1-yl]pyrido[1,2-a]benzimidazol-2-yl}propanoate
Catalog ID
STK963910
SMILES CCOC(=O)CCc1c(C)c(C#N)c2n(c1N1CCN(CC1)c1ccc(cc1)C)c1ccccc1n2
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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 C29H31N5O2 MW 481.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O2/c1-4-36-27(35)14-13-23-21(3)24(19-30)28-31-25-7-5-6-8-26(25)34(28)29(23)33-17-15-32(16-18-33)22-11-9-20(2)10-12-22/h5-12H,4,13-18H2,1-3H3InChIKey
CHJXXCUZDPUVSM-UHFFFAOYSA-NSynonyms
442567-59-1442567591
CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)C5=CC=C(C=C5)C
ethyl3(4cyano3methyl1(4(4methylphenyl)piperazin1yl)pyrido(12a)benzimidazol2yl)propanoate
ethyl3(4cyano3methyl1(4(ptolyl)piperazin1yl)benzo(45)imidazo(12a)pyridin2yl)propanoate
InChI=1SC29H31N5O2c143627(35)14132321(3)24(1930)283125756826(25)34(28)29(23)33171532(161833)2211920(2)101222h512H41318H213H3
MFCD02366825
ZINC000000638001
ZINC00638001
ZINC638001
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