2-[4-[4-(1-benzothiophen-3-yl)-2H-azet-1-yl]piperazin-1-yl]-4-methoxy-pyrimidine

Systemtic Name: 2-[4-[4-(1-benzothiophen-3-yl)-2H-azet-1-yl]piperazin-1-yl]-4-methoxy-pyrimidine Openeye Name: 2-[4-[4-(benzothiophen-3-yl)-2H-azet-1-yl]piperazin-1-yl]-4-methoxy-pyrimidine CAS Name: 2-[4-[4-(1-benzothiophen-3-yl)-2H-azet-1-yl]-1-piperazinyl]-4-methoxypyrimidine IUPAC Name: 2-[4-[4-(1-benzothiophen-3-yl)-2H-azet-1-yl]piperazin-1-yl]-4-methoxypyrimidine Traditional Name: 2-[4-[4-(benzothiophen-3-yl)-2H-azet-1-yl]piperazino]-4-methoxy-pyrimidine Formula: C20H21N5OS MolecularWeight: 379.47864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCN(CC2)N3CC=C3C4=CSC5=CC=CC=C54

Isomeric SMILES

COC1=NC(=NC=C1)N2CCN(CC2)N3CC=C3C4=CSC5=CC=CC=C54

InChI

InChI=1S/C20H21N5OS/c1-26-19-6-8-21-20(22-19)23-10-12-24(13-11-23)25-9-7-17(25)16-14-27-18-5-3-2-4-15(16)18/h2-8,14H,9-13H2,1H3