N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(1-methyl-2-oxo-4-quinolinyl)thio]acetamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-2-[(2-keto-1-methyl-4-quinolyl)thio]acetamide Formula: C20H19BrN2O3S MolecularWeight: 447.34546

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C20H19BrN2O3S/c1-23-16-6-4-3-5-15(16)18(10-20(23)25)27-12-19(24)22-11-13-9-14(21)7-8-17(13)26-2/h3-10H,11-12H2,1-2H3,(H,22,24)