Vitas-M small molecule compound

2-{[5-(4-ethylpiperazin-1-yl)-2-nitrophenyl]sulfanyl}-1H-benzimidazole

Catalog ID
STK158169
SMILES CCN1CCN(CC1)c1ccc(c(c1)Sc1nc2c([nH]1)cccc2)[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 C19H21N5O2S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O2S/c1-2-22-9-11-23(12-10-22)14-7-8-17(24(25)26)18(13-14)27-19-20-15-5-3-4-6-16(15)21-19/h3-8,13H,2,9-12H2,1H3,(H,20,21)
InChIKey
IUEQXWALPVLROR-UHFFFAOYSA-N
Synonyms
597545-56-7
2((5(4ETHYL1PIPERAZINYL)2NITROPHENYL)THIO)1HBENZIMIDAZOLE
2((5(4ETHYLPIPERAZIN1YL)2NITROPHENYL)SULFANYL)1HBENZIMIDAZOLE
2((5(4ethylpiperazin1yl)2nitrophenyl)thio)1Hbenzo(d)imidazole
2((5(4ETHYLPIPERAZINO)2NITROPHENYL)THIO)1HBENZIMIDAZOLE
2(5(4ETHYLPIPERAZIN1YL)2NITROPHENYL)SULFANYL1HBENZIMIDAZOLE
597545567
CCN1CCN(CC1)c1ccc(c(c1)Sc1nc2c((nH)1)cccc2)(N+)(=O)(O)
CCN1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))SC3=NC4=CC=CC=C4N3
InChI=1SC19H21N5O2Sc122291123(121022)147817(24(25)26)18(1314)27192015534616(15)2119h3813H2912H21H3(H2021)
MFCD03923661
ZINC000004679334
ZINC4679334

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Available files

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