4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]pyrimidin-4-yl]-3-phenyl-piperazin-2-one

Systemtic Name: 4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]pyrimidin-4-yl]-3-phenyl-piperazin-2-one Openeye Name: 4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]pyrimidin-4-yl]-3-phenyl-piperazin-2-one CAS Name: 4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-4-pyrimidinyl]-3-phenyl-2-piperazinone IUPAC Name: 4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]pyrimidin-4-yl]-3-phenylpiperazin-2-one Traditional Name: 4-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]pyrimidin-4-yl]-3-phenyl-piperazin-2-one Formula: C25H26N6O2 MolecularWeight: 442.51294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2CCNC3=NC=CC(=N3)N4CCNC(=O)C4C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2CCNC3=NC=CC(=N3)N4CCNC(=O)C4C5=CC=CC=C5

InChI

InChI=1S/C25H26N6O2/c1-33-19-7-8-21-20(15-19)18(16-29-21)9-11-27-25-28-12-10-22(30-25)31-14-13-26-24(32)23(31)17-5-3-2-4-6-17/h2-8,10,12,15-16,23,29H,9,11,13-14H2,1H3,(H,26,32)(H,27,28,30)