(3-morpholin-4-ylsulfonylphenyl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Openeye Name: (3-morpholinosulfonylphenyl)methyl-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium CAS Name: [3-(4-morpholinylsulfonyl)phenyl]methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ammonium IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Traditional Name: (3-morpholinosulfonylbenzyl)-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium Formula: C21H27N4O4S2+ MolecularWeight: 463.59348

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)CC3=NN=C(O3)C4=CC=CS4

Isomeric SMILES

CCC[NH+](CC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)CC3=NN=C(O3)C4=CC=CS4

InChI

InChI=1S/C21H26N4O4S2/c1-2-8-24(16-20-22-23-21(29-20)19-7-4-13-30-19)15-17-5-3-6-18(14-17)31(26,27)25-9-11-28-12-10-25/h3-7,13-14H,2,8-12,15-16H2,1H3/p+1