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

Systemtic Name: 2-[5-[3-[(4-methylsulfonylphenyl)methyl]-1,2,4-oxadiazol-5-yl]-1H-indol-3-yl]ethanamine Openeye Name: 2-[5-[3-[(4-methylsulfonylphenyl)methyl]-1,2,4-oxadiazol-5-yl]-1H-indol-3-yl]ethanamine CAS Name: 2-[5-[3-[(4-methylsulfonylphenyl)methyl]-1,2,4-oxadiazol-5-yl]-1H-indol-3-yl]ethanamine IUPAC Name: 2-[5-[3-[(4-methylsulfonylphenyl)methyl]-1,2,4-oxadiazol-5-yl]-1H-indol-3-yl]ethanamine Traditional Name: 2-[5-[3-(4-mesylbenzyl)-1,2,4-oxadiazol-5-yl]-1H-indol-3-yl]ethylamine Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC2=NOC(=N2)C3=CC4=C(C=C3)NC=C4CCN

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC2=NOC(=N2)C3=CC4=C(C=C3)NC=C4CCN

InChI

InChI=1S/C20H20N4O3S/c1-28(25,26)16-5-2-13(3-6-16)10-19-23-20(27-24-19)14-4-7-18-17(11-14)15(8-9-21)12-22-18/h2-7,11-12,22H,8-10,21H2,1H3