4-(4-oxidanylidenequinazolin-3-yl)-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]butanamide

Systemtic Name: 4-(4-oxidanylidenequinazolin-3-yl)-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]butanamide Openeye Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: 4-(4-oxo-3-quinazolinyl)-N-[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]butanamide IUPAC Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[4-[(4-benzylpiperazino)methyl]phenyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C30H33N5O2 MolecularWeight: 495.61532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC3=CC=C(C=C3)NC(=O)CCCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC3=CC=C(C=C3)NC(=O)CCCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C30H33N5O2/c36-29(11-6-16-35-23-31-28-10-5-4-9-27(28)30(35)37)32-26-14-12-25(13-15-26)22-34-19-17-33(18-20-34)21-24-7-2-1-3-8-24/h1-5,7-10,12-15,23H,6,11,16-22H2,(H,32,36)