4-[(4-azanylquinazolin-2-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[(4-azanylquinazolin-2-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[(4-aminoquinazolin-2-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[(4-amino-2-quinazolinyl)methyl]-N-(4-methoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[(4-aminoquinazolin-2-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[(4-aminoquinazolin-2-yl)methyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide Formula: C21H24N6O2 MolecularWeight: 392.45426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C21H24N6O2/c1-29-16-8-6-15(7-9-16)23-21(28)27-12-10-26(11-13-27)14-19-24-18-5-3-2-4-17(18)20(22)25-19/h2-9H,10-14H2,1H3,(H,23,28)(H2,22,24,25)