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

Systemtic Name: 3-azanyl-2-[4-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)butyl]quinazolin-4-one Openeye Name: 3-amino-2-[4-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)butyl]quinazolin-4-one CAS Name: 3-amino-2-[4-[4-(4-pyrrolo[1,2-a]quinoxalinyl)-1-piperazinyl]butyl]-4-quinazolinone IUPAC Name: 3-amino-2-[4-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)butyl]quinazolin-4-one Traditional Name: 3-amino-2-[4-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazino)butyl]quinazolin-4-one Formula: C27H29N7O MolecularWeight: 467.56546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=NC3=CC=CC=C3C(=O)N2N)C4=NC5=CC=CC=C5N6C4=CC=C6

Isomeric SMILES

C1CN(CCN1CCCCC2=NC3=CC=CC=C3C(=O)N2N)C4=NC5=CC=CC=C5N6C4=CC=C6

InChI

InChI=1S/C27H29N7O/c28-34-25(29-21-9-2-1-8-20(21)27(34)35)13-5-6-14-31-16-18-32(19-17-31)26-24-12-7-15-33(24)23-11-4-3-10-22(23)30-26/h1-4,7-12,15H,5-6,13-14,16-19,28H2