N-(3,5-ditert-butylphenyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(3,5-ditert-butylphenyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(3,5-ditert-butylphenyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-(3,5-ditert-butylphenyl)-2-(2-quinolinylthio)acetamide IUPAC Name: N-(3,5-ditert-butylphenyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(3,5-ditert-butylphenyl)-2-(2-quinolylthio)acetamide Formula: C25H30N2OS MolecularWeight: 406.5835

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C=C2)C(C)(C)C

InChI

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