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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-methylphenyl)-5-oxidanylidene-imidazol-2-yl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethylene)-5-oxo-1-(p-tolyl)imidazol-2-yl]sulfanyl-N-propyl-acetamide CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-methylphenyl)-5-oxo-2-imidazolyl]thio]-N-propylacetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethylidene)-1-(4-methylphenyl)-5-oxoimidazol-2-yl]sulfanyl-N-propylacetamide Traditional Name: 2-[[5-keto-4-piperonylidene-1-(p-tolyl)-2-imidazolin-2-yl]thio]-N-propyl-acetamide Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O4S/c1-3-10-24-21(27)13-31-23-25-18(11-16-6-9-19-20(12-16)30-14-29-19)22(28)26(23)17-7-4-15(2)5-8-17/h4-9,11-12H,3,10,13-14H2,1-2H3,(H,24,27)