Vitas-M small molecule compound
1-[(3-chloro-4-methylphenyl)amino]-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Catalog ID
STK531726
SMILES CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccc(c(c1)Cl)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 C28H31ClN4 MW 459.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN4/c1-4-5-6-7-8-9-12-22-20(3)23(18-30)28-32-25-13-10-11-14-26(25)33(28)27(22)31-21-16-15-19(2)24(29)17-21/h10-11,13-17,31H,4-9,12H2,1-3H3InChIKey
IQRSCTQKTHLGCN-UHFFFAOYSA-NSynonyms
305336-14-51((3chloro4methylphenyl)amino)3methyl2octylbenzo(45)imidazo(12a)pyridine4carbonitrile
1((3chloro4methylphenyl)amino)3methyl2octylpyrido(12a)benzimidazole4carbonitrile
1(3CHLORO4METHYLANILINO)3METHYL2OCTYLPYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
305336145
4((3CHLORO4METHYLPHENYL)AMINO)2METHYL3OCTYL5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
CCCCCCCCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NC4=CC(=C(C=C4)C)Cl
InChI=1SC28H31ClN4c1456789122220(3)23(1830)2832251310111426(25)33(28)27(22)3121161519(2)24(29)1721h1011131731H4912H213H3
MFCD01462630
ZINC000050860236
ZINC50860236
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