3-ethyl-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-ethyl-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[3-(2-nitrophenyl)prop-2-enylideneamino]-1H-1,2,4-triazole-5-thione Formula: C13H13N5O2S MolecularWeight: 303.33962

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1=NNC(=S)N1N=CC=CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O2S/c1-2-12-15-16-13(21)17(12)14-9-5-7-10-6-3-4-8-11(10)18(19)20/h3-9H,2H2,1H3,(H,16,21)