(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate Openeye Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate CAS Name: 4-(1,3-dithian-2-yl)benzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 4-(1,3-dithian-2-yl)benzoate Traditional Name: 4-(1,3-dithian-2-yl)benzoic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N2O3S2/c23-19(15-7-9-16(10-8-15)20-26-11-4-12-27-20)24-13-17-21-22-18(25-17)14-5-2-1-3-6-14/h1-3,5-10,20H,4,11-13H2