Vitas-M small molecule compound

1-methyl-2-{2-[4-(4-methylphenyl)piperazin-1-yl]ethyl}-5-nitro-1H-benzimidazole

Catalog ID
STK796396
SMILES Cc1ccc(cc1)N1CCN(CC1)CCc1nc2c(n1C)ccc(c2)[N+](=O)[O-]

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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 C21H25N5O2 MW 379.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2/c1-16-3-5-17(6-4-16)25-13-11-24(12-14-25)10-9-21-22-19-15-18(26(27)28)7-8-20(19)23(21)2/h3-8,15H,9-14H2,1-2H3
InChIKey
HDVCLLJOAKNAMJ-UHFFFAOYSA-N
Synonyms
879466-06-5
1methyl2(2(4(4methylphenyl)piperazin1yl)ethyl)5nitro1Hbenzimidazole
1METHYL2(2(4(4METHYLPHENYL)PIPERAZIN1YL)ETHYL)5NITROBENZIMIDAZOLE
1methyl5nitro2(2(4(ptolyl)piperazin1yl)ethyl)1Hbenzo(d)imidazole
879466065
CC1=CC=C(C=C1)N2CCN(CC2)CCC3=NC4=C(N3C)C=CC(=C4)(N+)(=O)(O)
Cc1ccc(cc1)N1CCN(CC1)CCc1nc2c(n1C)ccc(c2)(N+)(=O)(O)
InChI=1SC21H25N5O2c1163517(6416)25131124(121425)1092122191518(26(27)28)7820(19)23(21)2h3815H914H212H3
MFCD06606346
ZINC000002328089
ZINC2328089

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Available files

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