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

Systemtic Name: 4-methoxy-N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-methoxy-N-[(2-methyl-8-quinolyl)carbamothioyl]-3-nitro-benzamide CAS Name: 4-methoxy-N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-methoxy-N-[(2-methyl-8-quinolyl)thiocarbamoyl]-3-nitro-benzamide Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4O4S/c1-11-6-7-12-4-3-5-14(17(12)20-11)21-19(28)22-18(24)13-8-9-16(27-2)15(10-13)23(25)26/h3-10H,1-2H3,(H2,21,22,24,28)