1-(azepan-1-yl)-2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(1-azepanyl)-2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[(5-p-phenetyl-1,3,4-oxadiazol-2-yl)thio]ethanone Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)N3CCCCCC3

InChI

InChI=1S/C18H23N3O3S/c1-2-23-15-9-7-14(8-10-15)17-19-20-18(24-17)25-13-16(22)21-11-5-3-4-6-12-21/h7-10H,2-6,11-13H2,1H3