[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(3-phenoxyphenyl)methanone

Systemtic Name: [4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(3-phenoxyphenyl)methanone Openeye Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-phenoxyphenyl)methanone CAS Name: [4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-(3-phenoxyphenyl)methanone IUPAC Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-phenoxyphenyl)methanone Traditional Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-(3-phenoxyphenyl)methanone Formula: C26H25N5O2 MolecularWeight: 439.509

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)C4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)C4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H25N5O2/c27-25-22-11-4-5-12-23(22)28-24(29-25)18-30-13-15-31(16-14-30)26(32)19-7-6-10-21(17-19)33-20-8-2-1-3-9-20/h1-12,17H,13-16,18H2,(H2,27,28,29)