N-(3-chloranyl-2-fluoranyl-phenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(3-chloro-2-fluoro-phenyl)-2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(3-chloro-2-fluorophenyl)-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(3-chloro-2-fluorophenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(3-chloro-2-fluoro-phenyl)-2-(4-p-cumenylsulfonylpiperazino)acetamide Formula: C21H25ClFN3O3S MolecularWeight: 453.957903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C(=CC=C3)Cl)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C(=CC=C3)Cl)F

InChI

InChI=1S/C21H25ClFN3O3S/c1-15(2)16-6-8-17(9-7-16)30(28,29)26-12-10-25(11-13-26)14-20(27)24-19-5-3-4-18(22)21(19)23/h3-9,15H,10-14H2,1-2H3,(H,24,27)