2-[(4-fluorophenyl)methyl-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]sulfonyl-amino]-N-phenyl-ethanamide

Systemtic Name: 2-[(4-fluorophenyl)methyl-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]sulfonyl-amino]-N-phenyl-ethanamide Openeye Name: 2-[(4-fluorophenyl)methyl-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]sulfonyl-amino]-N-phenyl-acetamide CAS Name: 2-[(4-fluorophenyl)methyl-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]sulfonylamino]-N-phenylacetamide IUPAC Name: 2-[(4-fluorophenyl)methyl-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]sulfonylamino]-N-phenylacetamide Traditional Name: 2-[(4-fluorobenzyl)-[4-(3-methylpiperidino)sulfonylphenyl]sulfonyl-amino]-N-phenyl-acetamide Formula: C27H30FN3O5S2 MolecularWeight: 559.672603

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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=C(C=C3)F)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=C(C=C3)F)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H30FN3O5S2/c1-21-6-5-17-30(18-21)37(33,34)25-13-15-26(16-14-25)38(35,36)31(19-22-9-11-23(28)12-10-22)20-27(32)29-24-7-3-2-4-8-24/h2-4,7-16,21H,5-6,17-20H2,1H3,(H,29,32)