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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[1-(2-isopropylphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(1-o-cumenylimidazol-2-yl)thio]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O3S/c1-14(2)16-5-3-4-6-17(16)24-10-9-22-21(24)28-12-20(25)23-15-7-8-18-19(11-15)27-13-26-18/h3-11,14H,12-13H2,1-2H3,(H,23,25)