2-(4-oxidanylidenequinazolin-3-yl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(4-oxidanylidenequinazolin-3-yl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: 2-(4-oxo-3-quinazolinyl)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-(4-ketoquinazolin-3-yl)acetamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C27H27N5O2/c33-26(19-32-20-28-25-9-5-4-8-24(25)27(32)34)29-22-10-12-23(13-11-22)31-16-14-30(15-17-31)18-21-6-2-1-3-7-21/h1-13,20H,14-19H2,(H,29,33)