3-(2-methylpropoxy)-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide

Systemtic Name: 3-(2-methylpropoxy)-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide Openeye Name: 3-isobutoxy-N-[(2-methyl-5-quinolyl)carbamothioyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[[(2-methyl-5-quinolinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide Traditional Name: 3-isobutoxy-N-[(2-methyl-5-quinolyl)thiocarbamoyl]benzamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

InChI

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