2-[(4-bromophenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-[(4-bromophenyl)methyl-(p-tolylsulfonyl)amino]-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[(4-bromophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-[(4-bromophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[(4-bromobenzyl)-tosyl-amino]-N-(tetrahydrofurfuryl)acetamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Br)CC(=O)NCC3CCCO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Br)CC(=O)NCC3CCCO3

InChI

InChI=1S/C21H25BrN2O4S/c1-16-4-10-20(11-5-16)29(26,27)24(14-17-6-8-18(22)9-7-17)15-21(25)23-13-19-3-2-12-28-19/h4-11,19H,2-3,12-15H2,1H3,(H,23,25)