N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-2-(2,5-dimethylphenoxy)ethanamide

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-2-(2,5-dimethylphenoxy)ethanamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]-2-(2,5-dimethylphenoxy)acetamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]-2-(2,5-dimethylphenoxy)acetamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]-2-(2,5-dimethylphenoxy)acetamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]-2-(2,5-dimethylphenoxy)acetamide Formula: C17H16ClN3O4S MolecularWeight: 393.84464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O4S/c1-10-3-4-11(2)15(7-10)25-9-16(22)20-17(26)19-12-5-6-13(18)14(8-12)21(23)24/h3-8H,9H2,1-2H3,(H2,19,20,22,26)