1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-5-nitro-benzimidazole

Systemtic Name: 1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-5-nitro-benzimidazole Openeye Name: 1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-5-nitro-benzimidazole CAS Name: 1-ethyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-5-nitrobenzimidazole IUPAC Name: 1-ethyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-5-nitrobenzimidazole Traditional Name: 1-ethyl-2-[[(4-methylpyrimidin-2-yl)thio]methyl]-5-nitro-benzimidazole Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CSC3=NC=CC(=N3)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CSC3=NC=CC(=N3)C

InChI

InChI=1S/C15H15N5O2S/c1-3-19-13-5-4-11(20(21)22)8-12(13)18-14(19)9-23-15-16-7-6-10(2)17-15/h4-8H,3,9H2,1-2H3