N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-4-(4-ketoquinazolin-3-yl)butyramide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H30N4O5S/c1-2-34-23-13-12-19(35(32,33)29-15-6-3-7-16-29)17-22(23)27-24(30)11-8-14-28-18-26-21-10-5-4-9-20(21)25(28)31/h4-5,9-10,12-13,17-18H,2-3,6-8,11,14-16H2,1H3,(H,27,30)