3-[2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]ethanoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]ethanoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(4,5-diphenyloxazol-2-yl)sulfanylacetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-[(4,5-diphenyl-2-oxazolyl)thio]-1-oxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]acetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-[(4,5-diphenyloxazol-2-yl)thio]acetyl]amino]propyl-dimethyl-ammonium Formula: C22H26N3O2S+ MolecularWeight: 396.52574

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCNC(=O)CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-25(2)15-9-14-23-19(26)16-28-22-24-20(17-10-5-3-6-11-17)21(27-22)18-12-7-4-8-13-18/h3-8,10-13H,9,14-16H2,1-2H3,(H,23,26)/p+1