3-(furan-2-yl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-furyl)-5-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-4-phenyl-1,2,4-triazole CAS Name: 3-(2-furanyl)-5-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-phenyl-1,2,4-triazole Traditional Name: 3-(2-furyl)-5-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]-4-phenyl-1,2,4-triazole Formula: C18H12N4O4S MolecularWeight: 380.37728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SC=CC3=CC=C(O3)[N+](=O)[O-])C4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2S/C=C/C3=CC=C(O3)[N+](=O)[O-])C4=CC=CO4

InChI

InChI=1S/C18H12N4O4S/c23-22(24)16-9-8-14(26-16)10-12-27-18-20-19-17(15-7-4-11-25-15)21(18)13-5-2-1-3-6-13/h1-12H/b12-10+