N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]-2-methyl-propanamide Openeye Name: N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]-2-methyl-propanamide CAS Name: N-[(4-methoxy-3-nitroanilino)-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[(4-methoxy-3-nitrophenyl)carbamothioyl]-2-methylpropanamide Traditional Name: N-[(4-methoxy-3-nitro-phenyl)thiocarbamoyl]-2-methyl-propionamide Formula: C12H15N3O4S MolecularWeight: 297.3302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=CC(=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=CC(=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O4S/c1-7(2)11(16)14-12(20)13-8-4-5-10(19-3)9(6-8)15(17)18/h4-7H,1-3H3,(H2,13,14,16,20)