N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(2-methyl-3-nitroanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(2-methyl-3-nitrophenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(2-methyl-3-nitro-phenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C16H14N4O6S MolecularWeight: 390.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O6S/c1-10-13(3-2-4-14(10)20(24)25)17-16(27)18-15(21)9-26-12-7-5-11(6-8-12)19(22)23/h2-8H,9H2,1H3,(H2,17,18,21,27)