1-(phenylmethyl)-N-pyrimidin-2-yl-azepan-3-amine

Systemtic Name: 1-(phenylmethyl)-N-pyrimidin-2-yl-azepan-3-amine Openeye Name: 1-benzyl-N-pyrimidin-2-yl-azepan-3-amine CAS Name: 1-(phenylmethyl)-N-(2-pyrimidinyl)-3-azepanamine IUPAC Name: 1-benzyl-N-pyrimidin-2-ylazepan-3-amine Traditional Name: (1-benzylazepan-3-yl)-(2-pyrimidyl)amine Formula: C17H22N4 MolecularWeight: 282.38338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(C1)NC2=NC=CC=N2)CC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC(C1)NC2=NC=CC=N2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N4/c1-2-7-15(8-3-1)13-21-12-5-4-9-16(14-21)20-17-18-10-6-11-19-17/h1-3,6-8,10-11,16H,4-5,9,12-14H2,(H,18,19,20)