5-nitro-1-[(3-propylimidazol-4-yl)methylsulfanyl]benzimidazole

Systemtic Name: 5-nitro-1-[(3-propylimidazol-4-yl)methylsulfanyl]benzimidazole Openeye Name: 5-nitro-1-[(3-propylimidazol-4-yl)methylsulfanyl]benzimidazole CAS Name: 5-nitro-1-[(3-propyl-4-imidazolyl)methylthio]benzimidazole IUPAC Name: 5-nitro-1-[(3-propylimidazol-4-yl)methylsulfanyl]benzimidazole Traditional Name: 5-nitro-1-[(3-propylimidazol-4-yl)methylthio]benzimidazole Formula: C14H15N5O2S MolecularWeight: 317.3662

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC=C1CSN2C=NC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C=NC=C1CSN2C=NC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O2S/c1-2-5-17-9-15-7-12(17)8-22-18-10-16-13-6-11(19(20)21)3-4-14(13)18/h3-4,6-7,9-10H,2,5,8H2,1H3