N-[(diphenylmethylidene)amino]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(diphenylmethylidene)amino]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(benzhydrylideneamino)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(diphenylmethylene)amino]-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(benzhydrylideneamino)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(benzhydrylideneamino)-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetamide Formula: C23H25N6O+ MolecularWeight: 401.4842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NN=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NN=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C23H24N6O/c30-21(18-28-14-16-29(17-15-28)23-24-12-7-13-25-23)26-27-22(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-13H,14-18H2,(H,26,30)/p+1