N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(furan-2-ylmethyl)-5-(4-methylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(furan-2-ylmethyl)-5-(4-methylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(2-furylmethyl)-5-(p-tolyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[1-(2-furanylmethyl)-5-(4-methylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(furan-2-ylmethyl)-5-(4-methylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: 2-[[1-(2-furfuryl)-5-(p-tolyl)imidazol-2-yl]thio]-N-piperonyl-acetamide Formula: C25H23N3O4S MolecularWeight: 461.53282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN=C(N2CC3=CC=CO3)SCC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN=C(N2CC3=CC=CO3)SCC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H23N3O4S/c1-17-4-7-19(8-5-17)21-13-27-25(28(21)14-20-3-2-10-30-20)33-15-24(29)26-12-18-6-9-22-23(11-18)32-16-31-22/h2-11,13H,12,14-16H2,1H3,(H,26,29)