ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium

Systemtic Name: ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium Openeye Name: ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]-[(5-phenylisoxazol-3-yl)methyl]ammonium CAS Name: ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-[(5-phenyl-3-isoxazolyl)methyl]ammonium IUPAC Name: ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium Traditional Name: ethyl-[2-keto-2-(2-thenylamino)ethyl]-[(5-phenylisoxazol-3-yl)methyl]ammonium Formula: C19H22N3O2S+ MolecularWeight: 356.46188

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NOC(=C1)C2=CC=CC=C2)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CC[NH+](CC1=NOC(=C1)C2=CC=CC=C2)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C19H21N3O2S/c1-2-22(14-19(23)20-12-17-9-6-10-25-17)13-16-11-18(24-21-16)15-7-4-3-5-8-15/h3-11H,2,12-14H2,1H3,(H,20,23)/p+1