3-[3-(4-phenylpiperazin-1-yl)propyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 3-[3-(4-phenylpiperazin-1-yl)propyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Openeye Name: 3-[3-(4-phenylpiperazin-1-yl)propyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione CAS Name: 3-[3-(4-phenyl-1-piperazinyl)propyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione IUPAC Name: 3-[3-(4-phenylpiperazin-1-yl)propyl]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Traditional Name: 3-[3-(4-phenylpiperazino)propyl]-1,5-dihydropyrimid[5,4-b]indole-2,4-quinone Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C(=O)C3=C(C4=CC=CC=C4N3)NC2=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCN2C(=O)C3=C(C4=CC=CC=C4N3)NC2=O)C5=CC=CC=C5

InChI

InChI=1S/C23H25N5O2/c29-22-21-20(18-9-4-5-10-19(18)24-21)25-23(30)28(22)12-6-11-26-13-15-27(16-14-26)17-7-2-1-3-8-17/h1-5,7-10,24H,6,11-16H2,(H,25,30)