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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(4-isopropylphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[1-(4-propan-2-ylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-p-cumenylimidazol-2-yl)thio]-N-piperonyl-acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=CN=C2SCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=CN=C2SCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H23N3O3S/c1-15(2)17-4-6-18(7-5-17)25-10-9-23-22(25)29-13-21(26)24-12-16-3-8-19-20(11-16)28-14-27-19/h3-11,15H,12-14H2,1-2H3,(H,24,26)