1-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[4-(1,3-benzothiazol-2-ylthio)-3-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-[4-(1,3-benzothiazol-2-ylthio)-3-nitro-benzylidene]-(1,2,4-triazol-4-yl)amine Formula: C16H10N6O2S2 MolecularWeight: 382.4196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)C=NN4C=NN=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)/C=N/N4C=NN=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H10N6O2S2/c23-22(24)13-7-11(8-19-21-9-17-18-10-21)5-6-15(13)26-16-20-12-3-1-2-4-14(12)25-16/h1-10H/b19-8+