N-[3-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]carbonylphenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[3-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]carbonylphenyl]-2,2-dimethyl-propanamide Openeye Name: N-[3-[4-[(4-aminoquinazolin-2-yl)methyl]piperazine-1-carbonyl]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[3-[[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[3-[4-[(4-aminoquinazolin-2-yl)methyl]piperazine-1-carbonyl]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[3-[4-[(4-aminoquinazolin-2-yl)methyl]piperazine-1-carbonyl]phenyl]-2,2-dimethyl-propionamide Formula: C25H30N6O2 MolecularWeight: 446.5447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C25H30N6O2/c1-25(2,3)24(33)27-18-8-6-7-17(15-18)23(32)31-13-11-30(12-14-31)16-21-28-20-10-5-4-9-19(20)22(26)29-21/h4-10,15H,11-14,16H2,1-3H3,(H,27,33)(H2,26,28,29)