Vitas-M small molecule compound
5-(cyclohexylsulfanyl)-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL432920
SMILES O=c1n(C)c2c(n1C)cc(c(c2)SC1CCCCC1)[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 C15H19N3O3S MW 321.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N3O3S/c1-16-11-8-13(18(20)21)14(9-12(11)17(2)15(16)19)22-10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3InChIKey
NLZZUNIFRNYSKG-UHFFFAOYSA-NSynonyms
5(cyclohexylsulfanyl)13dimethyl6nitro13dihydro2Hbenzimidazol2one
5cyclohexylsulfanyl13dimethyl6nitrobenzimidazol2one
CN1C2=CC(=C(C=C2N(C1=O)C)SC3CCCCC3)(N+)(=O)(O)
InChI=1SC15H19N3O3Sc11611813(18(20)21)14(912(11)17(2)15(16)19)22106435710h810H37H212H3
MFCD09221960
ZINC000009879941
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