3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]propanamide

Systemtic Name: 3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]propanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]propanamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C28H29N5O2/c34-27(15-14-26-30-25-9-5-4-8-24(25)28(35)31-26)29-22-10-12-23(13-11-22)33-18-16-32(17-19-33)20-21-6-2-1-3-7-21/h1-13H,14-20H2,(H,29,34)(H,30,31,35)