N-cyclopentyl-N-[(2-fluorophenyl)methyl]-4-(3-methylpiperidin-1-yl)sulfonyl-benzenesulfonamide

Systemtic Name: N-cyclopentyl-N-[(2-fluorophenyl)methyl]-4-(3-methylpiperidin-1-yl)sulfonyl-benzenesulfonamide Openeye Name: N-cyclopentyl-N-[(2-fluorophenyl)methyl]-4-[(3-methyl-1-piperidyl)sulfonyl]benzenesulfonamide CAS Name: N-cyclopentyl-N-[(2-fluorophenyl)methyl]-4-[(3-methyl-1-piperidinyl)sulfonyl]benzenesulfonamide IUPAC Name: N-cyclopentyl-N-[(2-fluorophenyl)methyl]-4-(3-methylpiperidin-1-yl)sulfonylbenzenesulfonamide Traditional Name: N-cyclopentyl-N-(2-fluorobenzyl)-4-(3-methylpiperidino)sulfonyl-benzenesulfonamide Formula: C24H31FN2O4S2 MolecularWeight: 494.642343

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3F)C4CCCC4

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3F)C4CCCC4

InChI

InChI=1S/C24H31FN2O4S2/c1-19-7-6-16-26(17-19)32(28,29)22-12-14-23(15-13-22)33(30,31)27(21-9-3-4-10-21)18-20-8-2-5-11-24(20)25/h2,5,8,11-15,19,21H,3-4,6-7,9-10,16-18H2,1H3