N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-(2-methylquinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-(2-methylquinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-(3,4-dimethoxyphenyl)methyleneamino]-2-[(2-methyl-4-quinolyl)sulfanyl]acetamide CAS Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-[(2-methyl-4-quinolinyl)thio]acetamide IUPAC Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-(2-methylquinolin-4-yl)sulfanylacetamide Traditional Name: 2-[(2-methyl-4-quinolyl)thio]-N-[(E)-veratrylideneamino]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)SCC(=O)NN=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)SCC(=O)N/N=C/C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H21N3O3S/c1-14-10-20(16-6-4-5-7-17(16)23-14)28-13-21(25)24-22-12-15-8-9-18(26-2)19(11-15)27-3/h4-12H,13H2,1-3H3,(H,24,25)/b22-12+