2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-(2-methylsulfanylphenyl)propanamide

Systemtic Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-(2-methylsulfanylphenyl)propanamide Openeye Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]sulfanyl-N-(2-methylsulfanylphenyl)propanamide CAS Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-2-imidazolyl]thio]-N-[2-(methylthio)phenyl]propanamide IUPAC Name: 2-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethylimidazol-2-yl]sulfanyl-N-(2-methylsulfanylphenyl)propanamide Traditional Name: 2-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-ethyl-imidazol-2-yl]thio]-N-[2-(methylthio)phenyl]propionamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1SC(C)C(=O)NC2=CC=CC=C2SC)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN1C(=CN=C1SC(C)C(=O)NC2=CC=CC=C2SC)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H25N3O3S2/c1-4-26-18(16-9-10-19-20(13-16)29-12-11-28-19)14-24-23(26)31-15(2)22(27)25-17-7-5-6-8-21(17)30-3/h5-10,13-15H,4,11-12H2,1-3H3,(H,25,27)