2-[(4-fluorophenyl)methyl-methylsulfonyl-amino]-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-fluorophenyl)methyl-methylsulfonyl-amino]-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-[(4-fluorophenyl)methyl-methylsulfonyl-amino]-N-[(4-morpholinosulfonylphenyl)methyl]acetamide CAS Name: 2-[(4-fluorophenyl)methyl-methylsulfonylamino]-N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-[(4-fluorophenyl)methyl-methylsulfonylamino]-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-[(4-fluorobenzyl)-mesyl-amino]-N-(4-morpholinosulfonylbenzyl)acetamide Formula: C21H26FN3O6S2 MolecularWeight: 499.576043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)F)CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)F)CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H26FN3O6S2/c1-32(27,28)25(15-18-2-6-19(22)7-3-18)16-21(26)23-14-17-4-8-20(9-5-17)33(29,30)24-10-12-31-13-11-24/h2-9H,10-16H2,1H3,(H,23,26)