N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide CAS Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-4-[(1-methyl-2-imidazolyl)methoxy]benzamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide Traditional Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)OCC3=NC=CN3C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)OCC3=NC=CN3C)C

InChI

InChI=1S/C22H25N3O2S/c1-16-4-9-20(14-17(16)2)28-13-11-24-22(26)18-5-7-19(8-6-18)27-15-21-23-10-12-25(21)3/h4-10,12,14H,11,13,15H2,1-3H3,(H,24,26)