N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,2-dimethyl-5-phenyl-imidazol-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,2-dimethyl-5-phenyl-imidazol-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,2-dimethyl-5-phenyl-imidazol-4-yl)sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2,2-dimethyl-5-phenyl-4-imidazolyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,2-dimethyl-5-phenylimidazol-4-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2,2-dimethyl-5-phenyl-imidazol-4-yl)thio]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(C(=N1)SCC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(N=C(C(=N1)SCC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C

InChI

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