1-(azepan-1-yl)-3-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[[5-(1-naphthyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-[[5-(1-naphthyl)-1,3,4-oxadiazol-2-yl]thio]propan-1-one Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCSC2=NN=C(O2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCCN(CC1)C(=O)CCSC2=NN=C(O2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H23N3O2S/c25-19(24-13-5-1-2-6-14-24)12-15-27-21-23-22-20(26-21)18-11-7-9-16-8-3-4-10-17(16)18/h3-4,7-11H,1-2,5-6,12-15H2