2-(3,9-diazabicyclo[3.3.1]nonan-9-yl)-4-phenyl-quinazoline

Systemtic Name: 2-(3,9-diazabicyclo[3.3.1]nonan-9-yl)-4-phenyl-quinazoline Openeye Name: 2-(3,9-diazabicyclo[3.3.1]nonan-9-yl)-4-phenyl-quinazoline CAS Name: 2-(3,9-diazabicyclo[3.3.1]nonan-9-yl)-4-phenylquinazoline IUPAC Name: 2-(3,9-diazabicyclo[3.3.1]nonan-9-yl)-4-phenylquinazoline Traditional Name: 2-(3,9-diazabicyclo[3.3.1]nonan-9-yl)-4-phenyl-quinazoline Formula: C21H22N4 MolecularWeight: 330.42618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CNCC(C1)N2C3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1CC2CNCC(C1)N2C3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C21H22N4/c1-2-7-15(8-3-1)20-18-11-4-5-12-19(18)23-21(24-20)25-16-9-6-10-17(25)14-22-13-16/h1-5,7-8,11-12,16-17,22H,6,9-10,13-14H2