(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone Openeye Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone CAS Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-[4-(2-pyrazinyl)-1-piperazinyl]methanone IUPAC Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone Traditional Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-(4-pyrazin-2-ylpiperazino)methanone Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C18H22N4OS/c1-13-2-3-15-14(10-13)11-16(24-15)18(23)22-8-6-21(7-9-22)17-12-19-4-5-20-17/h4-5,11-13H,2-3,6-10H2,1H3