1-(3,4-dimethylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-imidazole

Systemtic Name: 1-(3,4-dimethylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-imidazole Openeye Name: 1-(3,4-dimethylphenyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-imidazole CAS Name: 1-(3,4-dimethylphenyl)-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]imidazole IUPAC Name: 1-(3,4-dimethylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanylimidazole Traditional Name: 1-(3,4-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=C(C=C(C=C1)N2C=CN=C2SC=CC3=CC=C(O3)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O3S/c1-12-3-4-14(11-13(12)2)19-9-8-18-17(19)24-10-7-15-5-6-16(23-15)20(21)22/h3-11H,1-2H3/b10-7+