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

Systemtic Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-1-benzothiophen-5-yl]-N-methyl-methanesulfonamide Openeye Name: N-[2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]benzothiophen-5-yl]-N-methyl-methanesulfonamide CAS Name: N-[2-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-benzothiophen-5-yl]-N-methylmethanesulfonamide IUPAC Name: N-[2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1-benzothiophen-5-yl]-N-methylmethanesulfonamide Traditional Name: N-[2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]benzothiophen-5-yl]-N-methyl-methanesulfonamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O4S2/c1-23(31(3,27)28)18-6-9-20-16(14-18)15-21(30-20)22(26)25-12-10-24(11-13-25)17-4-7-19(29-2)8-5-17/h4-9,14-15H,10-13H2,1-3H3