1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]benzoic acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester IUPAC Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzoic acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3SCC(=O)N(C)C

Isomeric SMILES

CC(C1=NN=C(O1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3SCC(=O)N(C)C

InChI

InChI=1S/C21H21N3O4S/c1-14(19-22-23-20(28-19)15-9-5-4-6-10-15)27-21(26)16-11-7-8-12-17(16)29-13-18(25)24(2)3/h4-12,14H,13H2,1-3H3