Vitas-M small molecule compound

2-{[2-nitro-5-(piperazin-1-yl)phenyl]sulfanyl}-1H-benzimidazole

Catalog ID
STK157986
SMILES [O-][N+](=O)c1ccc(cc1Sc1nc2c([nH]1)cccc2)N1CCNCC1

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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 C17H17N5O2S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O2S/c23-22(24)15-6-5-12(21-9-7-18-8-10-21)11-16(15)25-17-19-13-3-1-2-4-14(13)20-17/h1-6,11,18H,7-10H2,(H,19,20)
InChIKey
QRERSVTUNDTFLK-UHFFFAOYSA-N
Synonyms
591726-33-9
(O)(N+)(=O)c1ccc(cc1Sc1nc2c((nH)1)cccc2)N1CCNCC1
2((2NITRO5(1PIPERAZINYL)PHENYL)THIO)1HBENZIMIDAZOLE
2((2NITRO5(PIPERAZIN1YL)PHENYL)SULFANYL)1HBENZIMIDAZOLE
2((2nitro5(piperazin1yl)phenyl)thio)1Hbenzo(d)imidazole
2(2NITRO5PIPERAZIN1YLPHENYL)SULFANYL1HBENZIMIDAZOLE
591726339
C1CN(CCN1)C2=CC(=C(C=C2)(N+)(=O)(O))SC3=NC4=CC=CC=C4N3
InChI=1SC17H17N5O2Sc2322(24)156512(21971881021)1116(15)25171913312414(13)2017h161118H710H2(H1920)
MFCD03690475
ZINC000004312324
ZINC4312324

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Available files

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