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

Systemtic Name: 3-[(4-nitrophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazol-4-amine Openeye Name: 3-[(4-nitrophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazol-4-amine CAS Name: 3-[(4-nitrophenyl)methylthio]-5-phenyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-nitrophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazol-4-amine Traditional Name: [3-[(4-nitrobenzyl)thio]-5-phenyl-1,2,4-triazol-4-yl]amine Formula: C15H13N5O2S MolecularWeight: 327.36102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O2S/c16-19-14(12-4-2-1-3-5-12)17-18-15(19)23-10-11-6-8-13(9-7-11)20(21)22/h1-9H,10,16H2