N-[(E)-1-phenylethylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: N-[(E)-1-phenylethylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Openeye Name: 3-benzylsulfanyl-N-[(E)-1-phenylethylideneamino]-1H-1,2,4-triazol-5-amine CAS Name: N-[(E)-1-phenylethylideneamino]-3-(phenylmethylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-benzylsulfanyl-N-[(E)-1-phenylethylideneamino]-1H-1,2,4-triazol-5-amine Traditional Name: [3-(benzylthio)-1H-1,2,4-triazol-5-yl]-[(E)-1-phenylethylideneamino]amine Formula: C17H17N5S MolecularWeight: 323.41538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC(=NN1)SCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C/C(=N\NC1=NC(=NN1)SCC2=CC=CC=C2)/C3=CC=CC=C3

InChI

InChI=1S/C17H17N5S/c1-13(15-10-6-3-7-11-15)19-20-16-18-17(22-21-16)23-12-14-8-4-2-5-9-14/h2-11H,12H2,1H3,(H2,18,20,21,22)/b19-13+