N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]ethanesulfonamide

Systemtic Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]ethanesulfonamide Openeye Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]ethanesulfonamide CAS Name: N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]ethanesulfonamide IUPAC Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]ethanesulfonamide Traditional Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]ethanesulfonamide Formula: C20H24N4O2S MolecularWeight: 384.49516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NCC1=NC2=CC=CC=C2C(=N1)NCCCC3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)NCC1=NC2=CC=CC=C2C(=N1)NCCCC3=CC=CC=C3

InChI

InChI=1S/C20H24N4O2S/c1-2-27(25,26)22-15-19-23-18-13-7-6-12-17(18)20(24-19)21-14-8-11-16-9-4-3-5-10-16/h3-7,9-10,12-13,22H,2,8,11,14-15H2,1H3,(H,21,23,24)