1-(azepan-1-yl)-2-(4-methoxyphenyl)sulfanyl-propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-(4-methoxyphenyl)sulfanyl-propan-1-one Openeye Name: 1-(azepan-1-yl)-2-(4-methoxyphenyl)sulfanyl-propan-1-one CAS Name: 1-(1-azepanyl)-2-[(4-methoxyphenyl)thio]-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-(4-methoxyphenyl)sulfanylpropan-1-one Traditional Name: 1-(azepan-1-yl)-2-[(4-methoxyphenyl)thio]propan-1-one Formula: C16H23NO2S MolecularWeight: 293.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)SC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C(=O)N1CCCCCC1)SC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H23NO2S/c1-13(16(18)17-11-5-3-4-6-12-17)20-15-9-7-14(19-2)8-10-15/h7-10,13H,3-6,11-12H2,1-2H3