N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-ketoquinazolin-3-yl)acetamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H24N4O4S/c27-21(15-25-16-23-20-8-4-3-7-19(20)22(25)28)24-17-9-11-18(12-10-17)31(29,30)26-13-5-1-2-6-14-26/h3-4,7-12,16H,1-2,5-6,13-15H2,(H,24,27)