1-(3-pyridin-4-ylpropyl)-4-pyrimidin-2-yl-1,4-diazepane

Systemtic Name: 1-(3-pyridin-4-ylpropyl)-4-pyrimidin-2-yl-1,4-diazepane Openeye Name: 1-[3-(4-pyridyl)propyl]-4-pyrimidin-2-yl-1,4-diazepane CAS Name: 1-(3-pyridin-4-ylpropyl)-4-(2-pyrimidinyl)-1,4-diazepane IUPAC Name: 1-(3-pyridin-4-ylpropyl)-4-pyrimidin-2-yl-1,4-diazepane Traditional Name: 1-[3-(4-pyridyl)propyl]-4-(2-pyrimidyl)-1,4-diazepane Formula: C17H23N5 MolecularWeight: 297.39802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=CC=N2)CCCC3=CC=NC=C3

Isomeric SMILES

C1CN(CCN(C1)C2=NC=CC=N2)CCCC3=CC=NC=C3

InChI

InChI=1S/C17H23N5/c1(4-16-5-9-18-10-6-16)11-21-12-3-13-22(15-14-21)17-19-7-2-8-20-17/h2,5-10H,1,3-4,11-15H2