2,4,6-tris[4-(imidazol-1-ylmethyl)phenyl]-1,3,5-triazine

Systemtic Name: 2,4,6-tris[4-(imidazol-1-ylmethyl)phenyl]-1,3,5-triazine Openeye Name: 2,4,6-tris[4-(imidazol-1-ylmethyl)phenyl]-1,3,5-triazine CAS Name: 2,4,6-tris[4-(1-imidazolylmethyl)phenyl]-1,3,5-triazine IUPAC Name: 2,4,6-tris[4-(imidazol-1-ylmethyl)phenyl]-1,3,5-triazine Traditional Name: 2,4,6-tris[4-(imidazol-1-ylmethyl)phenyl]-s-triazine Formula: C33H27N9 MolecularWeight: 549.62778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CN=C2)C3=NC(=NC(=N3)C4=CC=C(C=C4)CN5C=CN=C5)C6=CC=C(C=C6)CN7C=CN=C7

Isomeric SMILES

C1=CC(=CC=C1CN2C=CN=C2)C3=NC(=NC(=N3)C4=CC=C(C=C4)CN5C=CN=C5)C6=CC=C(C=C6)CN7C=CN=C7

InChI

InChI=1S/C33H27N9/c1-7-28(8-2-25(1)19-40-16-13-34-22-40)31-37-32(29-9-3-26(4-10-29)20-41-17-14-35-23-41)39-33(38-31)30-11-5-27(6-12-30)21-42-18-15-36-24-42/h1-18,22-24H,19-21H2