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

Systemtic Name: 3-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]azepan-2-one Openeye Name: 3-[[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]azepan-2-one CAS Name: 3-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]-2-azepanone IUPAC Name: 3-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]azepan-2-one Traditional Name: 3-[[5-(m-tolyl)-1,3,4-oxadiazol-2-yl]thio]azepan-2-one Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(O2)SC3CCCCNC3=O

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(O2)SC3CCCCNC3=O

InChI

InChI=1S/C15H17N3O2S/c1-10-5-4-6-11(9-10)14-17-18-15(20-14)21-12-7-2-3-8-16-13(12)19/h4-6,9,12H,2-3,7-8H2,1H3,(H,16,19)