2-dimethylaminoethyl 2-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoylamino]ethanoate

Systemtic Name: 2-dimethylaminoethyl 2-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoylamino]ethanoate Openeye Name: 2-dimethylaminoethyl 2-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoylamino]acetate CAS Name: 2-[[1-oxo-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]propyl]amino]acetic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 2-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoylamino]acetate Traditional Name: 2-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]propanoylamino]acetic acid 2-dimethylaminoethyl ester Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)OCCN(C)C)SCC1=NC(=NO1)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCC(=O)OCCN(C)C)SCC1=NC(=NO1)C2=CC=CC=C2

InChI

InChI=1S/C18H24N4O4S/c1-13(18(24)19-11-16(23)25-10-9-22(2)3)27-12-15-20-17(21-26-15)14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3,(H,19,24)