N-tert-butyl-N-(phenylmethyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-N-(phenylmethyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-benzyl-N-tert-butyl-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-tert-butyl-N-(phenylmethyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-benzyl-N-tert-butyl-2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-benzyl-N-tert-butyl-2-[(4,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C25H30N2OS MolecularWeight: 406.5835

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2OS/c1-17-12-19(3)24-21(13-17)18(2)14-22(26-24)29-16-23(28)27(25(4,5)6)15-20-10-8-7-9-11-20/h7-14H,15-16H2,1-6H3