4-ethoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 4-ethoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide Openeye Name: 4-ethoxy-3-nitro-N-[(4-phenylthiazol-2-yl)carbamothioyl]benzamide CAS Name: 4-ethoxy-3-nitro-N-[[(4-phenyl-2-thiazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethoxy-3-nitro-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide Traditional Name: 4-ethoxy-3-nitro-N-[(4-phenylthiazol-2-yl)thiocarbamoyl]benzamide Formula: C19H16N4O4S2 MolecularWeight: 428.48474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O4S2/c1-2-27-16-9-8-13(10-15(16)23(25)26)17(24)21-18(28)22-19-20-14(11-29-19)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H2,20,21,22,24,28)