(6-methyl-2,3-dihydro-1-benzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (6-methyl-2,3-dihydro-1-benzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone Openeye Name: (6-methyl-2,3-dihydrobenzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone CAS Name: (6-methyl-2,3-dihydro-1-benzothiophen-2-yl)-[4-(2-pyrazinyl)-1-piperazinyl]methanone IUPAC Name: (6-methyl-2,3-dihydro-1-benzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone Traditional Name: (6-methyl-2,3-dihydrobenzothiophen-2-yl)-(4-pyrazin-2-ylpiperazino)methanone Formula: C18H20N4OS MolecularWeight: 340.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C=C1

Isomeric SMILES

CC1=CC2=C(CC(S2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C=C1

InChI

InChI=1S/C18H20N4OS/c1-13-2-3-14-11-16(24-15(14)10-13)18(23)22-8-6-21(7-9-22)17-12-19-4-5-20-17/h2-5,10,12,16H,6-9,11H2,1H3