2-methyl-N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: 2-methyl-N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[(2-methyl-8-quinolyl)carbamothioyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitrobenzamide Traditional Name: 2-methyl-N-[(2-methyl-8-quinolyl)thiocarbamoyl]-3-nitro-benzamide Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=S)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C)C=C1

InChI

InChI=1S/C19H16N4O3S/c1-11-9-10-13-5-3-7-15(17(13)20-11)21-19(27)22-18(24)14-6-4-8-16(12(14)2)23(25)26/h3-10H,1-2H3,(H2,21,22,24,27)