(4-pyrimidin-2-ylpiperazin-1-yl)-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-3-yl)methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-3-yl)methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-3-yl)methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-3-yl)methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-3-yl)methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-3-yl)methanone Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC=C2C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCC2=C(CC1)SC=C2C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C18H22N4OS/c23-17(15-13-24-16-6-3-1-2-5-14(15)16)21-9-11-22(12-10-21)18-19-7-4-8-20-18/h4,7-8,13H,1-3,5-6,9-12H2