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

Systemtic Name: 2,2-dimethyl-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]propanamide Openeye Name: 2,2-dimethyl-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]propanamide CAS Name: 2,2-dimethyl-N-[(4-methyl-3-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[(4-methyl-3-nitrophenyl)carbamothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[(4-methyl-3-nitro-phenyl)thiocarbamoyl]propionamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3S/c1-8-5-6-9(7-10(8)16(18)19)14-12(20)15-11(17)13(2,3)4/h5-7H,1-4H3,(H2,14,15,17,20)