2-[(4-fluorophenyl)methyl-(4-piperidin-1-ylsulfonylphenyl)sulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)methyl-(4-piperidin-1-ylsulfonylphenyl)sulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(4-fluorophenyl)methyl-[4-(1-piperidylsulfonyl)phenyl]sulfonyl-amino]-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(4-fluorophenyl)methyl-[4-(1-piperidinylsulfonyl)phenyl]sulfonylamino]-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(4-fluorophenyl)methyl-(4-piperidin-1-ylsulfonylphenyl)sulfonylamino]-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(4-fluorobenzyl)-(4-piperidinosulfonylphenyl)sulfonyl-amino]-N-(4-piperidinosulfonylphenyl)acetamide Formula: C31H37FN4O7S3 MolecularWeight: 692.841483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(CC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(CC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C31H37FN4O7S3/c32-26-9-7-25(8-10-26)23-36(46(42,43)30-17-15-29(16-18-30)45(40,41)35-21-5-2-6-22-35)24-31(37)33-27-11-13-28(14-12-27)44(38,39)34-19-3-1-4-20-34/h7-18H,1-6,19-24H2,(H,33,37)