N-(cyclopentylideneamino)-3-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-(cyclopentylideneamino)-3-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-(cyclopentylideneamino)-3-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: N-(cyclopentylideneamino)-3-[(6-nitro-1H-benzimidazol-2-yl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: N-(cyclopentylideneamino)-3-[(6-nitro-1H-benzimidazol-2-yl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: (cyclopentylideneamino)-[3-[(6-nitro-1H-benzimidazol-2-yl)methylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C15H16N8O2S MolecularWeight: 372.40494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NNC2=NC(=NN2)SCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-])C1

Isomeric SMILES

C1CCC(=NNC2=NC(=NN2)SCC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-])C1

InChI

InChI=1S/C15H16N8O2S/c24-23(25)10-5-6-11-12(7-10)17-13(16-11)8-26-15-18-14(21-22-15)20-19-9-3-1-2-4-9/h5-7H,1-4,8H2,(H,16,17)(H2,18,20,21,22)