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N-[1-[2-(1-phenylethylamino)pyrimidin-5-yl]benzimidazol-1-ium-1-yl]butanamide

N-[1-[2-(1-phenylethylamino)pyrimidin-5-yl]benzimidazol-1-ium-1-yl]butanamide

Systemtic Name:N-[1-[2-(1-phenylethylamino)pyrimidin-5-yl]benzimidazol-1-ium-1-yl]butanamide
Openeye Name:N-[1-[2-(1-phenylethylamino)pyrimidin-5-yl]benzimidazol-1-ium-1-yl]butanamide
CAS Name:N-[1-[2-(1-phenylethylamino)-5-pyrimidinyl]-1-benzimidazol-1-iumyl]butanamide
IUPAC Name:N-[1-[2-(1-phenylethylamino)pyrimidin-5-yl]benzimidazol-1-ium-1-yl]butanamide
Traditional Name:N-[1-[2-(1-phenylethylamino)pyrimidin-5-yl]benzimidazol-1-ium-1-yl]butyramide
Formula: C23H25N6O+
MolecularWeight: 401.4842
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N[N+]1(C=NC2=CC=CC=C21)C3=CN=C(N=C3)NC(C)C4=CC=CC=C4


Isomeric SMILES

CCCC(=O)N[N+]1(C=NC2=CC=CC=C21)C3=CN=C(N=C3)NC(C)C4=CC=CC=C4


InChI

InChI=1S/C23H24N6O/c1-3-9-22(30)28-29(16-26-20-12-7-8-13-21(20)29)19-14-24-23(25-15-19)27-17(2)18-10-5-4-6-11-18/h4-8,10-17H,3,9H2,1-2H3,(H-,24,25,27,28,30)/p+1


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