N-[3-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine

Systemtic Name: N-[3-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine Openeye Name: N-[3-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine CAS Name: N-[3-(4-chlorophenyl)-5-(ethylthio)-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine IUPAC Name: N-[3-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine Traditional Name: [3-(4-chlorophenyl)-5-(ethylthio)-1,2,4-triazol-4-yl]-(4-nitrobenzylidene)amine Formula: C17H14ClN5O2S MolecularWeight: 387.84336

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1N=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CCSC1=NN=C(N1N=CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN5O2S/c1-2-26-17-21-20-16(13-5-7-14(18)8-6-13)22(17)19-11-12-3-9-15(10-4-12)23(24)25/h3-11H,2H2,1H3