1-(3,5-dimethylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-imidazole

Systemtic Name: 1-(3,5-dimethylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-imidazole Openeye Name: 1-(3,5-dimethylphenyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-imidazole CAS Name: 1-(3,5-dimethylphenyl)-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]imidazole IUPAC Name: 1-(3,5-dimethylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanylimidazole Traditional Name: 1-(3,5-dimethylphenyl)-2-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]imidazole Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SC=CC3=CC=C(O3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2S/C=C/C3=CC=C(O3)[N+](=O)[O-])C

InChI

InChI=1S/C17H15N3O3S/c1-12-9-13(2)11-14(10-12)19-7-6-18-17(19)24-8-5-15-3-4-16(23-15)20(21)22/h3-11H,1-2H3/b8-5+