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

Systemtic Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-methylphenyl)-5-oxidanylidene-imidazol-2-yl]sulfanyl-N-pentan-2-yl-ethanamide Openeye Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylene)-5-oxo-1-(p-tolyl)imidazol-2-yl]sulfanyl-N-(1-methylbutyl)acetamide CAS Name: 2-[[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-methylphenyl)-5-oxo-2-imidazolyl]thio]-N-pentan-2-ylacetamide IUPAC Name: 2-[(4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-methylphenyl)-5-oxoimidazol-2-yl]sulfanyl-N-pentan-2-ylacetamide Traditional Name: 2-[[(4Z)-5-keto-4-piperonylidene-1-(p-tolyl)-2-imidazolin-2-yl]thio]-N-(1-methylbutyl)acetamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NC(=CC2=CC3=C(C=C2)OCO3)C(=O)N1C4=CC=C(C=C4)C

Isomeric SMILES

CCCC(C)NC(=O)CSC1=N/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)N1C4=CC=C(C=C4)C

InChI

InChI=1S/C25H27N3O4S/c1-4-5-17(3)26-23(29)14-33-25-27-20(12-18-8-11-21-22(13-18)32-15-31-21)24(30)28(25)19-9-6-16(2)7-10-19/h6-13,17H,4-5,14-15H2,1-3H3,(H,26,29)/b20-12-