3,4,5-trimethoxy-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[(2-methyl-5-quinolyl)carbamothioyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[[(2-methyl-5-quinolinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[(2-methyl-5-quinolyl)thiocarbamoyl]benzamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4S/c1-12-8-9-14-15(22-12)6-5-7-16(14)23-21(29)24-20(25)13-10-17(26-2)19(28-4)18(11-13)27-3/h5-11H,1-4H3,(H2,23,24,25,29)