[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(2-methoxy-4-methylsulfanyl-phenyl)methanone

Systemtic Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(2-methoxy-4-methylsulfanyl-phenyl)methanone Openeye Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(2-methoxy-4-methylsulfanyl-phenyl)methanone CAS Name: [4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-[2-methoxy-4-(methylthio)phenyl]methanone IUPAC Name: [4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-(2-methoxy-4-methylsulfanylphenyl)methanone Traditional Name: [4-(3-fluorophenyl)sulfonylpiperazino]-[2-methoxy-4-(methylthio)phenyl]methanone Formula: C19H21FN2O4S2 MolecularWeight: 424.509443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C19H21FN2O4S2/c1-26-18-13-15(27-2)6-7-17(18)19(23)21-8-10-22(11-9-21)28(24,25)16-5-3-4-14(20)12-16/h3-7,12-13H,8-11H2,1-2H3