4-[1-(pyridin-2-ylmethyl)azepan-3-yl]quinazolin-2-amine

Systemtic Name: 4-[1-(pyridin-2-ylmethyl)azepan-3-yl]quinazolin-2-amine Openeye Name: 4-[1-(2-pyridylmethyl)azepan-3-yl]quinazolin-2-amine CAS Name: 4-[1-(2-pyridinylmethyl)-3-azepanyl]-2-quinazolinamine IUPAC Name: 4-[1-(pyridin-2-ylmethyl)azepan-3-yl]quinazolin-2-amine Traditional Name: [4-[1-(2-pyridylmethyl)azepan-3-yl]quinazolin-2-yl]amine Formula: C20H23N5 MolecularWeight: 333.43012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(C1)C2=NC(=NC3=CC=CC=C32)N)CC4=CC=CC=N4

Isomeric SMILES

C1CCN(CC(C1)C2=NC(=NC3=CC=CC=C32)N)CC4=CC=CC=N4

InChI

InChI=1S/C20H23N5/c21-20-23-18-10-2-1-9-17(18)19(24-20)15-7-4-6-12-25(13-15)14-16-8-3-5-11-22-16/h1-3,5,8-11,15H,4,6-7,12-14H2,(H2,21,23,24)