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

Systemtic Name: N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide Openeye Name: N-[4-[[(2S,6S)-2,6-dimethyl-1-piperidyl]sulfonyl]phenyl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: N-[4-[[(2S,6S)-2,6-dimethyl-1-piperidinyl]sulfonyl]phenyl]-2-(4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[4-[(2S,6S)-2,6-dimethylpiperidino]sulfonylphenyl]-2-(4-ketoquinazolin-3-yl)acetamide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C=NC4=CC=CC=C4C3=O)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3C=NC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C23H26N4O4S/c1-16-6-5-7-17(2)27(16)32(30,31)19-12-10-18(11-13-19)25-22(28)14-26-15-24-21-9-4-3-8-20(21)23(26)29/h3-4,8-13,15-17H,5-7,14H2,1-2H3,(H,25,28)/t16-,17-/m0/s1