1-[1-(4-fluorophenyl)ethyl]-1-methyl-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-[1-(4-fluorophenyl)ethyl]-1-methyl-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Openeye Name: 1-[1-(4-fluorophenyl)ethyl]-1-methyl-3-[[4-(1-piperidylsulfonyl)phenyl]methyl]urea CAS Name: 1-[1-(4-fluorophenyl)ethyl]-1-methyl-3-[[4-(1-piperidinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-[1-(4-fluorophenyl)ethyl]-1-methyl-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Traditional Name: 1-[1-(4-fluorophenyl)ethyl]-1-methyl-3-(4-piperidinosulfonylbenzyl)urea Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)N(C)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)F)N(C)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28FN3O3S/c1-17(19-8-10-20(23)11-9-19)25(2)22(27)24-16-18-6-12-21(13-7-18)30(28,29)26-14-4-3-5-15-26/h6-13,17H,3-5,14-16H2,1-2H3,(H,24,27)