1-(diethylamino)ethyl 2-[[2-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanethioyl]amino]ethanoate

Systemtic Name: 1-(diethylamino)ethyl 2-[[2-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanethioyl]amino]ethanoate Openeye Name: 1-(diethylamino)ethyl 2-[[2-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanethioyl]amino]acetate CAS Name: 2-[[2-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-sulfanylidenepropyl]amino]acetic acid 1-(diethylamino)ethyl ester IUPAC Name: 1-(diethylamino)ethyl 2-[[2-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanethioyl]amino]acetate Traditional Name: 2-[[2-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanethioyl]amino]acetic acid 1-(diethylamino)ethyl ester Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C)OC(=O)CNC(=S)C(C)CC1=NC(=NO1)C2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(C)OC(=O)CNC(=S)C(C)CC1=NC(=NO1)C2=CC=CC=C2

InChI

InChI=1S/C20H28N4O3S/c1-5-24(6-2)15(4)26-18(25)13-21-20(28)14(3)12-17-22-19(23-27-17)16-10-8-7-9-11-16/h7-11,14-15H,5-6,12-13H2,1-4H3,(H,21,28)