N-(diphenylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(diphenylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-benzhydryl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(diphenylmethyl)-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-benzhydryl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-benzhydryl-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetamide Formula: C23H26N5O+ MolecularWeight: 388.48544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N5O/c29-21(18-27-14-16-28(17-15-27)23-24-12-7-13-25-23)26-22(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-13,22H,14-18H2,(H,26,29)/p+1