3-cyclopropyl-5-(4-fluoranyl-2-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-cyclopropyl-5-(4-fluoranyl-2-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazole Openeye Name: 3-cyclopropyl-5-(4-fluoro-2-nitro-phenyl)sulfanyl-4-phenyl-1,2,4-triazole CAS Name: 3-cyclopropyl-5-[(4-fluoro-2-nitrophenyl)thio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-cyclopropyl-5-(4-fluoro-2-nitrophenyl)sulfanyl-4-phenyl-1,2,4-triazole Traditional Name: 3-cyclopropyl-5-[(4-fluoro-2-nitro-phenyl)thio]-4-phenyl-1,2,4-triazole Formula: C17H13FN4O2S MolecularWeight: 356.374123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C17H13FN4O2S/c18-12-8-9-15(14(10-12)22(23)24)25-17-20-19-16(11-6-7-11)21(17)13-4-2-1-3-5-13/h1-5,8-11H,6-7H2