N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: 4-(4-ketoquinazolin-3-yl)-N-[3-[4-(m-tolyl)piperazino]propyl]butyramide Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C26H33N5O2/c1-21-7-4-8-22(19-21)30-17-15-29(16-18-30)13-6-12-27-25(32)11-5-14-31-20-28-24-10-3-2-9-23(24)26(31)33/h2-4,7-10,19-20H,5-6,11-18H2,1H3,(H,27,32)