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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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