Vitas-M small molecule compound
1-{4-[(1-methyl-5-nitro-1H-benzimidazol-2-yl)methyl]piperazin-1-yl}-2-phenoxyethanone
Catalog ID
STK612079
SMILES O=C(N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-])COc1ccccc1
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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 C21H23N5O4 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4/c1-23-19-8-7-16(26(28)29)13-18(19)22-20(23)14-24-9-11-25(12-10-24)21(27)15-30-17-5-3-2-4-6-17/h2-8,13H,9-12,14-15H2,1H3InChIKey
BWOBOLKHTXTPAB-UHFFFAOYSA-NSynonyms
895845-41-71(4((1methyl5nitro1Hbenzimidazol2yl)methyl)piperazin1yl)2phenoxyethanone
1(4((1methyl5nitro1Hbenzo(d)imidazol2yl)methyl)piperazin1yl)2phenoxyethanone
1(4((1METHYL5NITROBENZIMIDAZOL2YL)METHYL)PIPERAZIN1YL)2PHENOXYETHANONE
1(4(1METHYL5NITRO1HBENZOIMIDAZOL2YLMETHYL)PIPERAZIN1YL)2PHENOXYETHANONE
895845417
CN1C2=C(C=C(C=C2)(N+)(=O)(O))N=C1CN3CCN(CC3)C(=O)COC4=CC=CC=C4
InChI=1SC21H23N5O4c123198716(26(28)29)1318(19)2220(23)142491125(121024)21(27)1530175324617h2813H9121415H21H3
MFCD06600435
O=C(N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)(N+)(=O)(O))COc1ccccc1
ZINC000013003476
ZINC13003476
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