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

Systemtic Name: N-[4-fluoranyl-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-(4-methylsulfinylphenyl)benzamide Openeye Name: N-[4-fluoro-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-(4-methylsulfinylphenyl)benzamide CAS Name: N-[4-fluoro-3-(4-methyl-1-piperazinyl)phenyl]-3-methyl-4-(4-methylsulfinylphenyl)benzamide IUPAC Name: N-[4-fluoro-3-(4-methylpiperazin-1-yl)phenyl]-3-methyl-4-(4-methylsulfinylphenyl)benzamide Traditional Name: N-[4-fluoro-3-(4-methylpiperazino)phenyl]-3-methyl-4-(4-methylsulfinylphenyl)benzamide Formula: C26H28FN3O2S MolecularWeight: 465.582823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)F)N3CCN(CC3)C)C4=CC=C(C=C4)S(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)F)N3CCN(CC3)C)C4=CC=C(C=C4)S(=O)C

InChI

InChI=1S/C26H28FN3O2S/c1-18-16-20(6-10-23(18)19-4-8-22(9-5-19)33(3)32)26(31)28-21-7-11-24(27)25(17-21)30-14-12-29(2)13-15-30/h4-11,16-17H,12-15H2,1-3H3,(H,28,31)