1-[(5-fluoranyl-1-benzothiophen-2-yl)sulfonyl]-4-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazine

Systemtic Name: 1-[(5-fluoranyl-1-benzothiophen-2-yl)sulfonyl]-4-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazine Openeye Name: 1-(5-fluorobenzothiophen-2-yl)sulfonyl-4-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazine CAS Name: 1-[(5-fluoro-1-benzothiophen-2-yl)sulfonyl]-4-[(1-pyridin-4-yl-4-piperidinyl)methyl]piperazine IUPAC Name: 1-[(5-fluoro-1-benzothiophen-2-yl)sulfonyl]-4-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazine Traditional Name: 1-(5-fluorobenzothiophen-2-yl)sulfonyl-4-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazine Formula: C23H27FN4O2S2 MolecularWeight: 474.614483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCN(CC2)S(=O)(=O)C3=CC4=C(S3)C=CC(=C4)F)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CN2CCN(CC2)S(=O)(=O)C3=CC4=C(S3)C=CC(=C4)F)C5=CC=NC=C5

InChI

InChI=1S/C23H27FN4O2S2/c24-20-1-2-22-19(15-20)16-23(31-22)32(29,30)28-13-11-26(12-14-28)17-18-5-9-27(10-6-18)21-3-7-25-8-4-21/h1-4,7-8,15-16,18H,5-6,9-14,17H2