3-methyl-4-[(4-nitrophenyl)methylamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-methyl-4-[(4-nitrophenyl)methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-methyl-4-[(4-nitrophenyl)methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-[(4-nitrophenyl)methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-[(4-nitrophenyl)methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-[(4-nitrobenzyl)amino]-1H-1,2,4-triazole-5-thione Formula: C10H11N5O2S MolecularWeight: 265.29164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1NCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N1NCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H11N5O2S/c1-7-12-13-10(18)14(7)11-6-8-2-4-9(5-3-8)15(16)17/h2-5,11H,6H2,1H3,(H,13,18)