4-[4-[3-(1-benzofuran-3-yl)propyl]-3-methyl-piperazin-1-yl]-5-methoxy-pyrimidine

Systemtic Name: 4-[4-[3-(1-benzofuran-3-yl)propyl]-3-methyl-piperazin-1-yl]-5-methoxy-pyrimidine Openeye Name: 4-[4-[3-(benzofuran-3-yl)propyl]-3-methyl-piperazin-1-yl]-5-methoxy-pyrimidine CAS Name: 4-[4-[3-(3-benzofuranyl)propyl]-3-methyl-1-piperazinyl]-5-methoxypyrimidine IUPAC Name: 4-[4-[3-(1-benzofuran-3-yl)propyl]-3-methylpiperazin-1-yl]-5-methoxypyrimidine Traditional Name: 4-[4-[3-(benzofuran-3-yl)propyl]-3-methyl-piperazino]-5-methoxy-pyrimidine Formula: C21H26N4O2 MolecularWeight: 366.45674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CCCC2=COC3=CC=CC=C32)C4=NC=NC=C4OC

Isomeric SMILES

CC1CN(CCN1CCCC2=COC3=CC=CC=C32)C4=NC=NC=C4OC

InChI

InChI=1S/C21H26N4O2/c1-16-13-25(21-20(26-2)12-22-15-23-21)11-10-24(16)9-5-6-17-14-27-19-8-4-3-7-18(17)19/h3-4,7-8,12,14-16H,5-6,9-11,13H2,1-2H3