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

Systemtic Name: N-[(E)-(4-bromophenyl)methylideneamino]-2-(2,6-dimethylquinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-(4-bromophenyl)methyleneamino]-2-[(2,6-dimethyl-4-quinolyl)sulfanyl]acetamide CAS Name: N-[(E)-(4-bromophenyl)methylideneamino]-2-[(2,6-dimethyl-4-quinolinyl)thio]acetamide IUPAC Name: N-[(E)-(4-bromophenyl)methylideneamino]-2-(2,6-dimethylquinolin-4-yl)sulfanylacetamide Traditional Name: N-[(E)-(4-bromobenzylidene)amino]-2-[(2,6-dimethyl-4-quinolyl)thio]acetamide Formula: C20H18BrN3OS MolecularWeight: 428.34542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2SCC(=O)NN=CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2SCC(=O)N/N=C/C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H18BrN3OS/c1-13-3-8-18-17(9-13)19(10-14(2)23-18)26-12-20(25)24-22-11-15-4-6-16(21)7-5-15/h3-11H,12H2,1-2H3,(H,24,25)/b22-11+