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

Systemtic Name: N-[(E)-1-naphthalen-2-ylethylideneamino]-3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Openeye Name: 3-benzylsulfanyl-N-[(E)-1-(2-naphthyl)ethylideneamino]-1H-1,2,4-triazol-5-amine CAS Name: N-[(E)-1-(2-naphthalenyl)ethylideneamino]-3-(phenylmethylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-benzylsulfanyl-N-[(E)-1-naphthalen-2-ylethylideneamino]-1H-1,2,4-triazol-5-amine Traditional Name: [3-(benzylthio)-1H-1,2,4-triazol-5-yl]-[(E)-1-(2-naphthyl)ethylideneamino]amine Formula: C21H19N5S MolecularWeight: 373.47406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC(=NN1)SCC2=CC=CC=C2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=N\NC1=NC(=NN1)SCC2=CC=CC=C2)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H19N5S/c1-15(18-12-11-17-9-5-6-10-19(17)13-18)23-24-20-22-21(26-25-20)27-14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H2,22,24,25,26)/b23-15+