N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C25H30N4O4S/c1-18-7-5-8-19(2)29(18)34(32,33)21-14-12-20(13-15-21)27-24(30)11-6-16-28-17-26-23-10-4-3-9-22(23)25(28)31/h3-4,9-10,12-15,17-19H,5-8,11,16H2,1-2H3,(H,27,30)