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

Systemtic Name: [4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(3-iodanylphenyl)methanone Openeye Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-iodophenyl)methanone CAS Name: [4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-(3-iodophenyl)methanone IUPAC Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-iodophenyl)methanone Traditional Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-(3-iodophenyl)methanone Formula: C20H20IN5O MolecularWeight: 473.31017

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20IN5O/c21-15-5-3-4-14(12-15)20(27)26-10-8-25(9-11-26)13-18-23-17-7-2-1-6-16(17)19(22)24-18/h1-7,12H,8-11,13H2,(H2,22,23,24)