1-(4-bromophenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine

Systemtic Name: 1-(4-bromophenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine Openeye Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(4-bromophenyl)methanimine CAS Name: 1-(4-bromophenyl)-N-[3-(phenylmethylthio)-1,2,4-triazol-4-yl]methanimine IUPAC Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(4-bromophenyl)methanimine Traditional Name: (E)-[3-(benzylthio)-1,2,4-triazol-4-yl]-(4-bromobenzylidene)amine Formula: C16H13BrN4S MolecularWeight: 373.27022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=CN2N=CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=CN2/N=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN4S/c17-15-8-6-13(7-9-15)10-19-21-12-18-20-16(21)22-11-14-4-2-1-3-5-14/h1-10,12H,11H2/b19-10+