N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-(4-oxidanylidenequinazolin-3-yl)ethanamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-(4-oxidanylidenequinazolin-3-yl)ethanamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-2-(4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: 2-(4-ketoquinazolin-3-yl)-N-(2-methoxy-5-piperidinosulfonyl-phenyl)acetamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H24N4O5S/c1-31-20-10-9-16(32(29,30)26-11-5-2-6-12-26)13-19(20)24-21(27)14-25-15-23-18-8-4-3-7-17(18)22(25)28/h3-4,7-10,13,15H,2,5-6,11-12,14H2,1H3,(H,24,27)