N-[(4-fluoranyl-3-methyl-phenyl)methyl]-4-methylsulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-4-methylsulfonyl-piperazine-1-carboxamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-4-methylsulfonyl-piperazine-1-carboxamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-4-methylsulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-4-methylsulfonylpiperazine-1-carboxamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-4-mesyl-piperazine-1-carboxamide Formula: C14H20FN3O3S MolecularWeight: 329.390303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C)F

InChI

InChI=1S/C14H20FN3O3S/c1-11-9-12(3-4-13(11)15)10-16-14(19)17-5-7-18(8-6-17)22(2,20)21/h3-4,9H,5-8,10H2,1-2H3,(H,16,19)