[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(2-methylsulfanylphenyl)methanone

Systemtic Name: [4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: [4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-(2-methylsulfanylphenyl)methanone CAS Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: [4-(3-fluoro-4-methoxy-benzyl)piperazino]-[2-(methylthio)phenyl]methanone Formula: C20H23FN2O2S MolecularWeight: 374.472223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3SC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3SC)F

InChI

InChI=1S/C20H23FN2O2S/c1-25-18-8-7-15(13-17(18)21)14-22-9-11-23(12-10-22)20(24)16-5-3-4-6-19(16)26-2/h3-8,13H,9-12,14H2,1-2H3