N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)NC(C)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)N[C@H](C)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H23N3O3S/c1-14-8-15(2)10-18(9-14)25-7-6-23-22(25)29-12-21(26)24-16(3)17-4-5-19-20(11-17)28-13-27-19/h4-11,16H,12-13H2,1-3H3,(H,24,26)/t16-/m1/s1