1-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-[2-[(4-chlorophenyl)thio]-5-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-[2-(4-chlorophenyl)sulfanyl-5-nitrophenyl]-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-[2-[(4-chlorophenyl)thio]-5-nitro-benzylidene]-(1,2,4-triazol-4-yl)amine Formula: C15H10ClN5O2S MolecularWeight: 359.7902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=C(C=C2)[N+](=O)[O-])C=NN3C=NN=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=C(C=C2)[N+](=O)[O-])/C=N/N3C=NN=C3)Cl

InChI

InChI=1S/C15H10ClN5O2S/c16-12-1-4-14(5-2-12)24-15-6-3-13(21(22)23)7-11(15)8-19-20-9-17-18-10-20/h1-10H/b19-8+