(6E)-6-[4-(4-bromophenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-(4-bromophenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[3-allylsulfanyl-4-(4-bromophenyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-(4-bromophenyl)-3-(prop-2-enylthio)-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-(4-bromophenyl)-3-prop-2-enylsulfanyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[3-(allylthio)-4-(4-bromophenyl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H14BrN3OS MolecularWeight: 388.28156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NNC(=C2C=CC=CC2=O)N1C3=CC=C(C=C3)Br

Isomeric SMILES

C=CCSC1=NN/C(=C/2\C=CC=CC2=O)/N1C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H14BrN3OS/c1-2-11-23-17-20-19-16(14-5-3-4-6-15(14)22)21(17)13-9-7-12(18)8-10-13/h2-10,19H,1,11H2/b16-14-