2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: 2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-N-(isobutylcarbamoyl)propanamide CAS Name: 2-[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: 2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-N-(isobutylcarbamoyl)propionamide Formula: C21H31N7O2 MolecularWeight: 413.51654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C(C)N1CCN(CC1)CC2=NC3=CC=CC=C3C(=N2)N

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C(C)N1CCN(CC1)CC2=NC3=CC=CC=C3C(=N2)N

InChI

InChI=1S/C21H31N7O2/c1-14(2)12-23-21(30)26-20(29)15(3)28-10-8-27(9-11-28)13-18-24-17-7-5-4-6-16(17)19(22)25-18/h4-7,14-15H,8-13H2,1-3H3,(H2,22,24,25)(H2,23,26,29,30)