N'-(4,6-dimethylpyrimidin-2-yl)-1-[4-(diphenylmethyl)piperazine-1,4-diium-1-ylidene]methanediamine

Systemtic Name: N'-(4,6-dimethylpyrimidin-2-yl)-1-[4-(diphenylmethyl)piperazine-1,4-diium-1-ylidene]methanediamine Openeye Name: 1-(4-benzhydrylpiperazine-1,4-diium-1-ylidene)-N'-(4,6-dimethylpyrimidin-2-yl)methanediamine CAS Name: N'-(4,6-dimethyl-2-pyrimidinyl)-1-[4-(diphenylmethyl)-1-piperazine-1,4-diiumylidene]methanediamine IUPAC Name: 1-(4-benzhydrylpiperazine-1,4-diium-1-ylidene)-N'-(4,6-dimethylpyrimidin-2-yl)methanediamine Traditional Name: [amino-(4-benzhydrylpiperazine-1,4-diium-1-ylidene)methyl]-(4,6-dimethylpyrimidin-2-yl)amine Formula: C24H30N6+2 MolecularWeight: 402.5352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=[N+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=[N+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)N)C

InChI

InChI=1S/C24H28N6/c1-18-17-19(2)27-24(26-18)28-23(25)30-15-13-29(14-16-30)22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,17,22H,13-16H2,1-2H3,(H2,25,26,27,28)/p+2