3,5-dimethyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1,2-oxazole-4-sulfonamide

Systemtic Name: 3,5-dimethyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1,2-oxazole-4-sulfonamide Openeye Name: 3,5-dimethyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]isoxazole-4-sulfonamide CAS Name: 3,5-dimethyl-N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-4-isoxazolesulfonamide IUPAC Name: 3,5-dimethyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1,2-oxazole-4-sulfonamide Traditional Name: 3,5-dimethyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]isoxazole-4-sulfonamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NCC2=NC3=CC=CC=C3C(=N2)NCCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NCC2=NC3=CC=CC=C3C(=N2)NCCCC4=CC=CC=C4

InChI

InChI=1S/C23H25N5O3S/c1-16-22(17(2)31-28-16)32(29,30)25-15-21-26-20-13-7-6-12-19(20)23(27-21)24-14-8-11-18-9-4-3-5-10-18/h3-7,9-10,12-13,25H,8,11,14-15H2,1-2H3,(H,24,26,27)