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

Systemtic Name: 4-ethoxy-N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-ethoxy-N-[(2-methyl-8-quinolyl)carbamothioyl]-3-nitro-benzamide CAS Name: 4-ethoxy-N-[[(2-methyl-8-quinolinyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-[(2-methylquinolin-8-yl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-ethoxy-N-[(2-methyl-8-quinolyl)thiocarbamoyl]-3-nitro-benzamide Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2N=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2N=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S/c1-3-28-17-10-9-14(11-16(17)24(26)27)19(25)23-20(29)22-15-6-4-5-13-8-7-12(2)21-18(13)15/h4-11H,3H2,1-2H3,(H2,22,23,25,29)