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

Systemtic Name: 4-azanyl-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-[(5-nitro-1-indolyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-[(5-nitroindol-1-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C11H10N6O2S MolecularWeight: 290.3011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN2CC3=NNC(=S)N3N)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CN2CC3=NNC(=S)N3N)C=C1[N+](=O)[O-]

InChI

InChI=1S/C11H10N6O2S/c12-16-10(13-14-11(16)20)6-15-4-3-7-5-8(17(18)19)1-2-9(7)15/h1-5H,6,12H2,(H,14,20)