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

Systemtic Name: 4-(2-methylpropoxy)-N-[(2-methylquinolin-8-yl)carbamothioyl]benzamide Openeye Name: 4-isobutoxy-N-[(2-methyl-8-quinolyl)carbamothioyl]benzamide CAS Name: 4-(2-methylpropoxy)-N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(2-methylpropoxy)-N-[(2-methylquinolin-8-yl)carbamothioyl]benzamide Traditional Name: 4-isobutoxy-N-[(2-methyl-8-quinolyl)thiocarbamoyl]benzamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O2S/c1-14(2)13-27-18-11-9-17(10-12-18)21(26)25-22(28)24-19-6-4-5-16-8-7-15(3)23-20(16)19/h4-12,14H,13H2,1-3H3,(H2,24,25,26,28)