3-[2-[4-(4-bromophenyl)piperazin-1-yl]ethyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 3-[2-[4-(4-bromophenyl)piperazin-1-yl]ethyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Openeye Name: 3-[2-[4-(4-bromophenyl)piperazin-1-yl]ethyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione CAS Name: 3-[2-[4-(4-bromophenyl)-1-piperazinyl]ethyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione IUPAC Name: 3-[2-[4-(4-bromophenyl)piperazin-1-yl]ethyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Traditional Name: 3-[2-[4-(4-bromophenyl)piperazino]ethyl]-1,5-dihydropyrimid[5,4-b]indole-2,4-quinone Formula: C22H22BrN5O2 MolecularWeight: 468.34638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C3=C(C4=CC=CC=C4N3)NC2=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C3=C(C4=CC=CC=C4N3)NC2=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C22H22BrN5O2/c23-15-5-7-16(8-6-15)27-12-9-26(10-13-27)11-14-28-21(29)20-19(25-22(28)30)17-3-1-2-4-18(17)24-20/h1-8,24H,9-14H2,(H,25,30)