N-[(E)-(4-bromophenyl)methylideneamino]-2-(2,6,8-trimethylquinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-(4-bromophenyl)methylideneamino]-2-(2,6,8-trimethylquinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-(4-bromophenyl)methyleneamino]-2-[(2,6,8-trimethyl-4-quinolyl)sulfanyl]acetamide CAS Name: N-[(E)-(4-bromophenyl)methylideneamino]-2-[(2,6,8-trimethyl-4-quinolinyl)thio]acetamide IUPAC Name: N-[(E)-(4-bromophenyl)methylideneamino]-2-(2,6,8-trimethylquinolin-4-yl)sulfanylacetamide Traditional Name: N-[(E)-(4-bromobenzylidene)amino]-2-[(2,6,8-trimethyl-4-quinolyl)thio]acetamide Formula: C21H20BrN3OS MolecularWeight: 442.372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C)SCC(=O)NN=CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C)SCC(=O)N/N=C/C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C21H20BrN3OS/c1-13-8-14(2)21-18(9-13)19(10-15(3)24-21)27-12-20(26)25-23-11-16-4-6-17(22)7-5-16/h4-11H,12H2,1-3H3,(H,25,26)/b23-11+