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

Systemtic Name: N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[(2-methyl-8-quinolyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[(2-methyl-8-quinolyl)thiocarbamoyl]-3-nitro-benzamide Formula: C18H14N4O3S MolecularWeight: 366.39376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4O3S/c1-11-8-9-12-4-3-7-15(16(12)19-11)20-18(26)21-17(23)13-5-2-6-14(10-13)22(24)25/h2-10H,1H3,(H2,20,21,23,26)