3-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylazepan-2-one

Systemtic Name: 3-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylazepan-2-one Openeye Name: 3-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylazepan-2-one CAS Name: 3-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-2-azepanone IUPAC Name: 3-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylazepan-2-one Traditional Name: 3-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]azepan-2-one Formula: C15H25N3OS MolecularWeight: 295.4435

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SC2CCCCNC2=O)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SC2CCCCNC2=O)C)C

InChI

InChI=1S/C15H25N3OS/c1-4-5-10-18-12(3)11(2)17-15(18)20-13-8-6-7-9-16-14(13)19/h13H,4-10H2,1-3H3,(H,16,19)