5-(benzotriazol-1-ylmethyl)-N-[(E)-(2-nitrophenyl)methylideneamino]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(benzotriazol-1-ylmethyl)-N-[(E)-(2-nitrophenyl)methylideneamino]-1,3,4-thiadiazol-2-amine Openeye Name: 5-(benzotriazol-1-ylmethyl)-N-[(E)-(2-nitrophenyl)methyleneamino]-1,3,4-thiadiazol-2-amine CAS Name: 5-(1-benzotriazolylmethyl)-N-[(E)-(2-nitrophenyl)methylideneamino]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(benzotriazol-1-ylmethyl)-N-[(E)-(2-nitrophenyl)methylideneamino]-1,3,4-thiadiazol-2-amine Traditional Name: [5-(benzotriazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-[(E)-(2-nitrobenzylidene)amino]amine Formula: C16H12N8O2S MolecularWeight: 380.38388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC2=NN=C(S2)CN3C4=CC=CC=C4N=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/NC2=NN=C(S2)CN3C4=CC=CC=C4N=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N8O2S/c25-24(26)13-7-3-1-5-11(13)9-17-20-16-21-19-15(27-16)10-23-14-8-4-2-6-12(14)18-22-23/h1-9H,10H2,(H,20,21)/b17-9+