N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC(C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)N[C@H](C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O3S/c1-13-5-4-6-17-14(2)9-21(24-22(13)17)28-11-20(25)23-15(3)16-7-8-18-19(10-16)27-12-26-18/h4-10,15H,11-12H2,1-3H3,(H,23,25)/t15-/m1/s1