4-(4-oxidanylidenequinazolin-3-yl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]butanamide

Systemtic Name: 4-(4-oxidanylidenequinazolin-3-yl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]butanamide Openeye Name: 4-(4-oxoquinazolin-3-yl)-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]butanamide CAS Name: 4-(4-oxo-3-quinazolinyl)-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]butanamide IUPAC Name: 4-(4-oxoquinazolin-3-yl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]butanamide Traditional Name: 4-(4-ketoquinazolin-3-yl)-N-(2-piperidinosulfonylbenzyl)butyramide Formula: C24H28N4O4S MolecularWeight: 468.56852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H28N4O4S/c29-23(13-8-14-27-18-26-21-11-4-3-10-20(21)24(27)30)25-17-19-9-2-5-12-22(19)33(31,32)28-15-6-1-7-16-28/h2-5,9-12,18H,1,6-8,13-17H2,(H,25,29)