N-propan-2-yl-2-(4-pyrimidin-2-yl-1,4-diazepan-1-ium-1-yl)ethanamide

Systemtic Name: N-propan-2-yl-2-(4-pyrimidin-2-yl-1,4-diazepan-1-ium-1-yl)ethanamide Openeye Name: N-isopropyl-2-(4-pyrimidin-2-yl-1,4-diazepan-1-ium-1-yl)acetamide CAS Name: N-propan-2-yl-2-[4-(2-pyrimidinyl)-1,4-diazepan-1-ium-1-yl]acetamide IUPAC Name: N-propan-2-yl-2-(4-pyrimidin-2-yl-1,4-diazepan-1-ium-1-yl)acetamide Traditional Name: N-isopropyl-2-[4-(2-pyrimidyl)-1,4-diazepan-1-ium-1-yl]acetamide Formula: C14H24N5O+ MolecularWeight: 278.37326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCCN(CC1)C2=NC=CC=N2

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCCN(CC1)C2=NC=CC=N2

InChI

InChI=1S/C14H23N5O/c1-12(2)17-13(20)11-18-7-4-8-19(10-9-18)14-15-5-3-6-16-14/h3,5-6,12H,4,7-11H2,1-2H3,(H,17,20)/p+1