3-chloranyl-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-[4-(2-fluorobenzyl)piperazino]phenyl]benzothiophene-2-carboxamide Formula: C26H23ClFN3OS MolecularWeight: 479.996723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)C3=CC=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C26H23ClFN3OS/c27-24-21-6-2-4-8-23(21)33-25(24)26(32)29-19-9-11-20(12-10-19)31-15-13-30(14-16-31)17-18-5-1-3-7-22(18)28/h1-12H,13-17H2,(H,29,32)