N-[[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-(4-methylsulfonylphenyl)ethanamine

Systemtic Name: N-[[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-(4-methylsulfonylphenyl)ethanamine Openeye Name: N-[[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-(4-methylsulfonylphenyl)ethanamine CAS Name: N-[[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-(4-methylsulfonylphenyl)ethanamine IUPAC Name: N-[[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-(4-methylsulfonylphenyl)ethanamine Traditional Name: 1-(4-mesylphenyl)ethyl-[[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]amine Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NCC2=NC(=NO2)C3=CC=CC=C3OC

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NCC2=NC(=NO2)C3=CC=CC=C3OC

InChI

InChI=1S/C19H21N3O4S/c1-13(14-8-10-15(11-9-14)27(3,23)24)20-12-18-21-19(22-26-18)16-6-4-5-7-17(16)25-2/h4-11,13,20H,12H2,1-3H3