3,5-bis(4-naphthalen-1-ylnaphthalen-1-yl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazole

Systemtic Name: 3,5-bis(4-naphthalen-1-ylnaphthalen-1-yl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazole Openeye Name: 3,5-bis[4-(1-naphthyl)-1-naphthyl]-4-(2,4,6-trimethylphenyl)-1,2,4-triazole CAS Name: 3,5-bis[4-(1-naphthalenyl)-1-naphthalenyl]-4-(2,4,6-trimethylphenyl)-1,2,4-triazole IUPAC Name: 3,5-bis(4-naphthalen-1-ylnaphthalen-1-yl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazole Traditional Name: 4-mesityl-3,5-bis[4-(1-naphthyl)-1-naphthyl]-1,2,4-triazole Formula: C51H37N3 MolecularWeight: 691.85958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C(=NN=C2C3=CC=C(C4=CC=CC=C43)C5=CC=CC6=CC=CC=C65)C7=CC=C(C8=CC=CC=C87)C9=CC=CC1=CC=CC=C19)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C(=NN=C2C3=CC=C(C4=CC=CC=C43)C5=CC=CC6=CC=CC=C65)C7=CC=C(C8=CC=CC=C87)C9=CC=CC1=CC=CC=C19)C

InChI

InChI=1S/C51H37N3/c1-32-30-33(2)49(34(3)31-32)54-50(47-28-26-45(41-20-8-10-22-43(41)47)39-24-12-16-35-14-4-6-18-37(35)39)52-53-51(54)48-29-27-46(42-21-9-11-23-44(42)48)40-25-13-17-36-15-5-7-19-38(36)40/h4-31H,1-3H3