2-(4-methylquinolin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide

Systemtic Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Openeye Name: 2-[(4-methyl-2-quinolyl)sulfanyl]-N-(4-phenoxyphenyl)butanamide CAS Name: 2-[(4-methyl-2-quinolinyl)thio]-N-(4-phenoxyphenyl)butanamide IUPAC Name: 2-(4-methylquinolin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Traditional Name: 2-[(4-methyl-2-quinolyl)thio]-N-(4-phenoxyphenyl)butyramide Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24N2O2S/c1-3-24(31-25-17-18(2)22-11-7-8-12-23(22)28-25)26(29)27-19-13-15-21(16-14-19)30-20-9-5-4-6-10-20/h4-17,24H,3H2,1-2H3,(H,27,29)