2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-oxo-1-phenyl-imidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxo-1-phenyl-2-imidazolyl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-5-oxo-1-phenylimidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[(4Z)-5-keto-1-phenyl-4-piperonylidene-2-imidazolin-2-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C26H21N3O5S MolecularWeight: 487.52704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC(=CC3=CC4=C(C=C3)OCO4)C(=O)N2C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=N/C(=C\C3=CC4=C(C=C3)OCO4)/C(=O)N2C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O5S/c1-32-20-10-8-18(9-11-20)27-24(30)15-35-26-28-21(25(31)29(26)19-5-3-2-4-6-19)13-17-7-12-22-23(14-17)34-16-33-22/h2-14H,15-16H2,1H3,(H,27,30)/b21-13-