N-[3-fluoranyl-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-4-methyl-benzamide

Systemtic Name: N-[3-fluoranyl-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-4-methyl-benzamide Openeye Name: N-[3-fluoro-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-4-methyl-benzamide CAS Name: N-[3-fluoro-4-(4-methylsulfonyl-1-piperazinyl)phenyl]-4-methylbenzamide IUPAC Name: N-[3-fluoro-4-(4-methylsulfonylpiperazin-1-yl)phenyl]-4-methylbenzamide Traditional Name: N-[3-fluoro-4-(4-mesylpiperazino)phenyl]-4-methyl-benzamide Formula: C19H22FN3O3S MolecularWeight: 391.459683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)S(=O)(=O)C)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)S(=O)(=O)C)F

InChI

InChI=1S/C19H22FN3O3S/c1-14-3-5-15(6-4-14)19(24)21-16-7-8-18(17(20)13-16)22-9-11-23(12-10-22)27(2,25)26/h3-8,13H,9-12H2,1-2H3,(H,21,24)