S-[[5-[3-oxidanylidene-3-(4-phenylphenyl)propyl]-1,2,4-oxadiazol-3-yl]methyl] ethanethioate

Systemtic Name: S-[[5-[3-oxidanylidene-3-(4-phenylphenyl)propyl]-1,2,4-oxadiazol-3-yl]methyl] ethanethioate Openeye Name: S-[[5-[3-oxo-3-(4-phenylphenyl)propyl]-1,2,4-oxadiazol-3-yl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[5-[3-oxo-3-(4-phenylphenyl)propyl]-1,2,4-oxadiazol-3-yl]methyl] ester IUPAC Name: S-[[5-[3-oxo-3-(4-phenylphenyl)propyl]-1,2,4-oxadiazol-3-yl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[[5-[3-keto-3-(4-phenylphenyl)propyl]-1,2,4-oxadiazol-3-yl]methyl] ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=NOC(=N1)CCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SCC1=NOC(=N1)CCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O3S/c1-14(23)26-13-19-21-20(25-22-19)12-11-18(24)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-10H,11-13H2,1H3