(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methylphenyl)-2-(2-oxidanylidenecycloheptyl)sulfanyl-imidazol-4-one

Systemtic Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methylphenyl)-2-(2-oxidanylidenecycloheptyl)sulfanyl-imidazol-4-one Openeye Name: (5E)-5-(1,3-benzodioxol-5-ylmethylene)-2-(2-oxocycloheptyl)sulfanyl-3-(p-tolyl)imidazol-4-one CAS Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methylphenyl)-2-[(2-oxocycloheptyl)thio]-4-imidazolone IUPAC Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(4-methylphenyl)-2-(2-oxocycloheptyl)sulfanylimidazol-4-one Traditional Name: (5E)-2-[(2-ketocycloheptyl)thio]-5-piperonylidene-3-(p-tolyl)-2-imidazolin-4-one Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)N=C2SC5CCCCCC5=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC4=C(C=C3)OCO4)/N=C2SC5CCCCCC5=O

InChI

InChI=1S/C25H24N2O4S/c1-16-7-10-18(11-8-16)27-24(29)19(13-17-9-12-21-22(14-17)31-15-30-21)26-25(27)32-23-6-4-2-3-5-20(23)28/h7-14,23H,2-6,15H2,1H3/b19-13+