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

Systemtic Name: 4-naphthalen-1-yl-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(1-naphthyl)-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(1-naphthalenyl)-3-[(5-nitro-1-indolyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-naphthalen-1-yl-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(1-naphthyl)-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C21H15N5O2S MolecularWeight: 401.4411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3C(=NNC3=S)CN4C=CC5=C4C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3C(=NNC3=S)CN4C=CC5=C4C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O2S/c27-26(28)16-8-9-18-15(12-16)10-11-24(18)13-20-22-23-21(29)25(20)19-7-3-5-14-4-1-2-6-17(14)19/h1-12H,13H2,(H,23,29)