2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide

Systemtic Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Openeye Name: 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-(4-phenoxyphenyl)butanamide CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]-N-(4-phenoxyphenyl)butanamide IUPAC Name: 2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Traditional Name: 2-[(4,8-dimethyl-2-quinolyl)thio]-N-(4-phenoxyphenyl)butyramide Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=NC4=C(C=CC=C4C)C(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=NC4=C(C=CC=C4C)C(=C3)C

InChI

InChI=1S/C27H26N2O2S/c1-4-24(32-25-17-19(3)23-12-8-9-18(2)26(23)29-25)27(30)28-20-13-15-22(16-14-20)31-21-10-6-5-7-11-21/h5-17,24H,4H2,1-3H3,(H,28,30)