N-[2-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-1-benzothiophen-5-yl]-N-methyl-methanesulfonamide

Systemtic Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-1-benzothiophen-5-yl]-N-methyl-methanesulfonamide Openeye Name: N-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]benzothiophen-5-yl]-N-methyl-methanesulfonamide CAS Name: N-[2-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-1-benzothiophen-5-yl]-N-methylmethanesulfonamide IUPAC Name: N-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1-benzothiophen-5-yl]-N-methylmethanesulfonamide Traditional Name: N-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]benzothiophen-5-yl]-N-methyl-methanesulfonamide Formula: C21H22FN3O3S2 MolecularWeight: 447.546083

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4F)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC2=C(C=C1)SC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4F)S(=O)(=O)C

InChI

InChI=1S/C21H22FN3O3S2/c1-23(30(2,27)28)16-7-8-19-15(13-16)14-20(29-19)21(26)25-11-9-24(10-12-25)18-6-4-3-5-17(18)22/h3-8,13-14H,9-12H2,1-2H3