2,4,6-tris[4-(phenylmethyl)piperazin-1-yl]-1,3,5-triazine

Systemtic Name: 2,4,6-tris[4-(phenylmethyl)piperazin-1-yl]-1,3,5-triazine Openeye Name: 2,4,6-tris(4-benzylpiperazin-1-yl)-1,3,5-triazine CAS Name: 2,4,6-tris[4-(phenylmethyl)-1-piperazinyl]-1,3,5-triazine IUPAC Name: 2,4,6-tris(4-benzylpiperazin-1-yl)-1,3,5-triazine Traditional Name: 2,4,6-tris(4-benzylpiperazino)-s-triazine Formula: C36H45N9 MolecularWeight: 603.8028

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC(=NC(=N3)N4CCN(CC4)CC5=CC=CC=C5)N6CCN(CC6)CC7=CC=CC=C7

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC(=NC(=N3)N4CCN(CC4)CC5=CC=CC=C5)N6CCN(CC6)CC7=CC=CC=C7

InChI

InChI=1S/C36H45N9/c1-4-10-31(11-5-1)28-40-16-22-43(23-17-40)34-37-35(44-24-18-41(19-25-44)29-32-12-6-2-7-13-32)39-36(38-34)45-26-20-42(21-27-45)30-33-14-8-3-9-15-33/h1-15H,16-30H2