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

Systemtic Name: 3-(2-methylphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-nitrophenyl)methylsulfanyl]-5-(o-tolyl)-1,2,4-triazol-4-amine CAS Name: 3-(2-methylphenyl)-5-[(4-nitrophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-methylphenyl)-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-nitrobenzyl)thio]-5-(o-tolyl)-1,2,4-triazol-4-yl]amine Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2N)SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2N)SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O2S/c1-11-4-2-3-5-14(11)15-18-19-16(20(15)17)24-10-12-6-8-13(9-7-12)21(22)23/h2-9H,10,17H2,1H3