N-[[5-(4-bromophenyl)furan-2-yl]methyl]-4-(cyanomethylsulfonylmethyl)-N-methyl-benzamide

Systemtic Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-4-(cyanomethylsulfonylmethyl)-N-methyl-benzamide Openeye Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-4-(cyanomethylsulfonylmethyl)-N-methyl-benzamide CAS Name: N-[[5-(4-bromophenyl)-2-furanyl]methyl]-4-(cyanomethylsulfonylmethyl)-N-methylbenzamide IUPAC Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-4-(cyanomethylsulfonylmethyl)-N-methylbenzamide Traditional Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-4-(cyanomethylsulfonylmethyl)-N-methyl-benzamide Formula: C22H19BrN2O4S MolecularWeight: 487.36626

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(O1)C2=CC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)CS(=O)(=O)CC#N

Isomeric SMILES

CN(CC1=CC=C(O1)C2=CC=C(C=C2)Br)C(=O)C3=CC=C(C=C3)CS(=O)(=O)CC#N

InChI

InChI=1S/C22H19BrN2O4S/c1-25(14-20-10-11-21(29-20)17-6-8-19(23)9-7-17)22(26)18-4-2-16(3-5-18)15-30(27,28)13-12-24/h2-11H,13-15H2,1H3