Vitas-M small molecule compound
2-(2-chlorobenzyl)-3-methyl-1-(octylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Catalog ID
STK953692
SMILES CCCCCCCCNc1c(Cc2ccccc2Cl)c(C)c(c2n1c1ccccc1n2)C#N
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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/c1-3-4-5-6-7-12-17-31-27-22(18-21-13-8-9-14-24(21)29)20(2)23(19-30)28-32-25-15-10-11-16-26(25)33(27)28/h8-11,13-16,31H,3-7,12,17-18H2,1-2H3InChIKey
IPZGROKYVKJIHF-UHFFFAOYSA-NSynonyms
2((2CHLOROPHENYL)METHYL)3METHYL1(OCTYLAMINO)PYRIDO(12A)BENZIMIDAZOLE4CARBONITRILE
2(2chlorobenzyl)3methyl1(octylamino)pyrido(12a)benzimidazole4carbonitrile
3((2CHLOROPHENYL)METHYL)2METHYL4(OCTYLAMINO)5HYDROPYRIDINO(12A)BENZIMIDAZOLECARBONITRILE
CCCCCCCCNC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC4=CC=CC=C4Cl
InChI=1SC28H31ClN4c1345671217312722(182113891424(21)29)20(2)23(1930)2832251510111626(25)33(27)28h811131631H37121718H212H3
MFCD05686120
ZINC000098047669
ZINC98047669
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