Vitas-M small molecule compound
N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-3-nitrobenzamide
Catalog ID
STK544688
SMILES CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1cccc(c1)[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/c1-26-10-9-16(17-19-14-7-2-3-8-15(14)20-17)21-18(23)12-5-4-6-13(11-12)22(24)25/h2-8,11,16H,9-10H2,1H3,(H,19,20)(H,21,23)InChIKey
XEIZYCMPGPOAJZ-UHFFFAOYSA-NSynonyms
488090-20-6488090206
CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
CSCCC(c1nc2c((nH)1)cccc2)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC18H18N4O3Sc12610916(171914723815(14)2017)2118(23)1254613(1112)22(24)25h281116H910H21H3(H1920)(H2123)
MFCD03287977
N(1(1Hbenzimidazol2yl)3(methylsulfanyl)propyl)3nitrobenzamide
N(1(1HBENZIMIDAZOL2YL)3METHYLSULFANYLPROPYL)3NITROBENZAMIDE
N(1(1Hbenzo(d)imidazol2yl)3(methylthio)propyl)3nitrobenzamide
N(1(1HBENZOIMIDAZOL2YL)3METHYLSULFANYLPROPYL)3NITROBENZAMIDE
ZINC000013142490
ZINC000013142491
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