3-(2-methoxyphenyl)-5-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-methoxyphenyl)-5-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2-methoxyphenyl)-5-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2-methoxyphenyl)-5-[(3-nitrophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-methoxyphenyl)-5-[(3-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2-methoxyphenyl)-5-[(3-nitrobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2N)SCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2N)SCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O3S/c1-24-14-8-3-2-7-13(14)15-18-19-16(20(15)17)25-10-11-5-4-6-12(9-11)21(22)23/h2-9H,10,17H2,1H3