N-[(2R)-3,3-dimethylbutan-2-yl]-4-(quinolin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(2R)-3,3-dimethylbutan-2-yl]-4-(quinolin-2-ylsulfanylmethyl)benzamide Openeye Name: 4-(2-quinolylsulfanylmethyl)-N-[(1R)-1,2,2-trimethylpropyl]benzamide CAS Name: N-[(2R)-3,3-dimethylbutan-2-yl]-4-[(2-quinolinylthio)methyl]benzamide IUPAC Name: N-[(2R)-3,3-dimethylbutan-2-yl]-4-(quinolin-2-ylsulfanylmethyl)benzamide Traditional Name: 4-[(2-quinolylthio)methyl]-N-[(1R)-1,2,2-trimethylpropyl]benzamide Formula: C23H26N2OS MolecularWeight: 378.53034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(C)(C)C)NC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H26N2OS/c1-16(23(2,3)4)24-22(26)19-11-9-17(10-12-19)15-27-21-14-13-18-7-5-6-8-20(18)25-21/h5-14,16H,15H2,1-4H3,(H,24,26)/t16-/m1/s1