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

Systemtic Name: N-[3-ethylsulfanyl-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine Openeye Name: N-[3-ethylsulfanyl-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine CAS Name: N-[3-(ethylthio)-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine IUPAC Name: N-[3-ethylsulfanyl-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]-1-(4-nitrophenyl)methanimine Traditional Name: [3-(ethylthio)-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]-(4-nitrobenzylidene)amine Formula: C18H17N5O3S MolecularWeight: 383.42428

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H17N5O3S/c1-3-27-18-21-20-17(14-6-10-16(26-2)11-7-14)22(18)19-12-13-4-8-15(9-5-13)23(24)25/h4-12H,3H2,1-2H3