3-[(5-nitroindol-1-yl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(5-nitroindol-1-yl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(5-nitroindol-1-yl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(5-nitro-1-indolyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(5-nitroindol-1-yl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(5-nitroindol-1-yl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C17H13N5O2S MolecularWeight: 351.38242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CN3C=CC4=C3C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CN3C=CC4=C3C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O2S/c23-22(24)14-6-7-15-12(10-14)8-9-20(15)11-16-18-19-17(25)21(16)13-4-2-1-3-5-13/h1-10H,11H2,(H,19,25)