Vitas-M small molecule compound
N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-nitrobenzamide
Catalog ID
STK544064
SMILES CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1ccc(cc1)[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 C18H18N4O3S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3S/c1-26-11-10-16(17-19-14-4-2-3-5-15(14)20-17)21-18(23)12-6-8-13(9-7-12)22(24)25/h2-9,16H,10-11H2,1H3,(H,19,20)(H,21,23)InChIKey
IZFJTCZANHFTOO-UHFFFAOYSA-NSynonyms
488852-48-8488852488
CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CSCCC(c1nc2c((nH)1)cccc2)NC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H18N4O3Sc126111016(171914423515(14)2017)2118(23)126813(9712)22(24)25h2916H1011H21H3(H1920)(H2123)
MFCD03294720
N((1R)1(1HBENZIMIDAZOL2YL)3(METHYLSULFANYL)PROPYL)4NITROBENZAMIDE
N(1(1Hbenzimidazol2yl)3(methylsulfanyl)propyl)4nitrobenzamide
N(1(1HBENZIMIDAZOL2YL)3METHYLSULFANYLPROPYL)4NITROBENZAMIDE
N(1(1Hbenzo(d)imidazol2yl)3(methylthio)propyl)4nitrobenzamide
ZINC000002206363
ZINC000012618165
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