N-[(3-fluoranyl-4-methyl-phenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanamide Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetamide CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)acetamide IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide Traditional Name: N-(3-fluoro-4-methyl-benzyl)-2-[4-(2-thienylsulfonyl)piperazino]acetamide Formula: C18H22FN3O3S2 MolecularWeight: 411.513983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CS3)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CS3)F

InChI

InChI=1S/C18H22FN3O3S2/c1-14-4-5-15(11-16(14)19)12-20-17(23)13-21-6-8-22(9-7-21)27(24,25)18-3-2-10-26-18/h2-5,10-11H,6-9,12-13H2,1H3,(H,20,23)