(3S)-3-[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanylazepan-2-one

Systemtic Name: (3S)-3-[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanylazepan-2-one Openeye Name: (3S)-3-[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanylazepan-2-one CAS Name: (3S)-3-[[1-(2-methoxyphenyl)-5-phenyl-2-imidazolyl]thio]-2-azepanone IUPAC Name: (3S)-3-[1-(2-methoxyphenyl)-5-phenylimidazol-2-yl]sulfanylazepan-2-one Traditional Name: (3S)-3-[[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]thio]azepan-2-one Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=CN=C2SC3CCCCNC3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2C(=CN=C2S[C@H]3CCCCNC3=O)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2S/c1-27-19-12-6-5-11-17(19)25-18(16-9-3-2-4-10-16)15-24-22(25)28-20-13-7-8-14-23-21(20)26/h2-6,9-12,15,20H,7-8,13-14H2,1H3,(H,23,26)/t20-/m0/s1