[(2R)-4-methyl-2-phenyl-piperazin-1-yl]-[3-(methylsulfanylmethyl)-1-benzofuran-2-yl]methanone

Systemtic Name: [(2R)-4-methyl-2-phenyl-piperazin-1-yl]-[3-(methylsulfanylmethyl)-1-benzofuran-2-yl]methanone Openeye Name: [(2R)-4-methyl-2-phenyl-piperazin-1-yl]-[3-(methylsulfanylmethyl)benzofuran-2-yl]methanone CAS Name: [(2R)-4-methyl-2-phenyl-1-piperazinyl]-[3-[(methylthio)methyl]-2-benzofuranyl]methanone IUPAC Name: [(2R)-4-methyl-2-phenylpiperazin-1-yl]-[3-(methylsulfanylmethyl)-1-benzofuran-2-yl]methanone Traditional Name: [(2R)-4-methyl-2-phenyl-piperazino]-[3-[(methylthio)methyl]benzofuran-2-yl]methanone Formula: C22H24N2O2S MolecularWeight: 380.50316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4O3)CSC

Isomeric SMILES

CN1CCN([C@@H](C1)C2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4O3)CSC

InChI

InChI=1S/C22H24N2O2S/c1-23-12-13-24(19(14-23)16-8-4-3-5-9-16)22(25)21-18(15-27-2)17-10-6-7-11-20(17)26-21/h3-11,19H,12-15H2,1-2H3/t19-/m0/s1