4-tert-butyl-N-[(2-methylquinolin-8-yl)carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(2-methylquinolin-8-yl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(2-methyl-8-quinolyl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(2-methylquinolin-8-yl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(2-methyl-8-quinolyl)thiocarbamoyl]benzamide Formula: C22H23N3OS MolecularWeight: 377.50252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C=C1

InChI

InChI=1S/C22H23N3OS/c1-14-8-9-15-6-5-7-18(19(15)23-14)24-21(27)25-20(26)16-10-12-17(13-11-16)22(2,3)4/h5-13H,1-4H3,(H2,24,25,26,27)