3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[2-keto-2-(4-phenylpiperazino)ethyl]-5H-pyrimid[5,4-b]indol-4-one Formula: C22H21N5O2 MolecularWeight: 387.43444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CN3C=NC4=C(C3=O)NC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CN3C=NC4=C(C3=O)NC5=CC=CC=C54

InChI

InChI=1S/C22H21N5O2/c28-19(26-12-10-25(11-13-26)16-6-2-1-3-7-16)14-27-15-23-20-17-8-4-5-9-18(17)24-21(20)22(27)29/h1-9,15,24H,10-14H2