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

Systemtic Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-2-(4-methylphenoxy)ethanamide Openeye Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]-2-(4-methylphenoxy)acetamide CAS Name: N-[(2-methyl-3-nitroanilino)-sulfanylidenemethyl]-2-(4-methylphenoxy)acetamide IUPAC Name: N-[(2-methyl-3-nitrophenyl)carbamothioyl]-2-(4-methylphenoxy)acetamide Traditional Name: N-[(2-methyl-3-nitro-phenyl)thiocarbamoyl]-2-(4-methylphenoxy)acetamide Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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