2-[3-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)propylamino]-1H-quinazolin-4-one

Systemtic Name: 2-[3-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)propylamino]-1H-quinazolin-4-one Openeye Name: 2-[3-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)propylamino]-1H-quinazolin-4-one CAS Name: 2-[3-[4-(4-pyrrolo[1,2-a]quinoxalinyl)-1-piperazinyl]propylamino]-1H-quinazolin-4-one IUPAC Name: 2-[3-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)propylamino]-1H-quinazolin-4-one Traditional Name: 2-[3-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazino)propylamino]-1H-quinazolin-4-one Formula: C26H27N7O MolecularWeight: 453.53888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC2=NC(=O)C3=CC=CC=C3N2)C4=NC5=CC=CC=C5N6C4=CC=C6

Isomeric SMILES

C1CN(CCN1CCCNC2=NC(=O)C3=CC=CC=C3N2)C4=NC5=CC=CC=C5N6C4=CC=C6

InChI

InChI=1S/C26H27N7O/c34-25-19-7-1-2-8-20(19)29-26(30-25)27-12-6-13-31-15-17-32(18-16-31)24-23-11-5-14-33(23)22-10-4-3-9-21(22)28-24/h1-5,7-11,14H,6,12-13,15-18H2,(H2,27,29,30,34)