2-(2,5-dimethylphenoxy)-N-[(4-nitrophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(2,5-dimethylphenoxy)-N-[(4-nitrophenyl)carbamothioyl]ethanamide Openeye Name: 2-(2,5-dimethylphenoxy)-N-[(4-nitrophenyl)carbamothioyl]acetamide CAS Name: 2-(2,5-dimethylphenoxy)-N-[(4-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2,5-dimethylphenoxy)-N-[(4-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(2,5-dimethylphenoxy)-N-[(4-nitrophenyl)thiocarbamoyl]acetamide Formula: C17H17N3O4S MolecularWeight: 359.39958

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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)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4S/c1-11-3-4-12(2)15(9-11)24-10-16(21)19-17(25)18-13-5-7-14(8-6-13)20(22)23/h3-9H,10H2,1-2H3,(H2,18,19,21,25)