N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)N4CCCCC4

InChI

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