N5,N5-bis[(3-phenoxyphenyl)methyl]-3H-benzimidazole-2,5-diamine

Systemtic Name: N5,N5-bis[(3-phenoxyphenyl)methyl]-3H-benzimidazole-2,5-diamine Openeye Name: N5,N5-bis[(3-phenoxyphenyl)methyl]-3H-benzimidazole-2,5-diamine CAS Name: N5,N5-bis[(3-phenoxyphenyl)methyl]-3H-benzimidazole-2,5-diamine IUPAC Name: 5-N,5-N-bis[(3-phenoxyphenyl)methyl]-3H-benzimidazole-2,5-diamine Traditional Name: (2-amino-3H-benzimidazol-5-yl)-bis(3-phenoxybenzyl)amine Formula: C33H28N4O2 MolecularWeight: 512.60102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CN(CC3=CC(=CC=C3)OC4=CC=CC=C4)C5=CC6=C(C=C5)N=C(N6)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CN(CC3=CC(=CC=C3)OC4=CC=CC=C4)C5=CC6=C(C=C5)N=C(N6)N

InChI

InChI=1S/C33H28N4O2/c34-33-35-31-18-17-26(21-32(31)36-33)37(22-24-9-7-15-29(19-24)38-27-11-3-1-4-12-27)23-25-10-8-16-30(20-25)39-28-13-5-2-6-14-28/h1-21H,22-23H2,(H3,34,35,36)