2,2-dimethyl-N-[(4-nitrophenyl)carbamothioyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[(4-nitrophenyl)carbamothioyl]propanamide Openeye Name: 2,2-dimethyl-N-[(4-nitrophenyl)carbamothioyl]propanamide CAS Name: 2,2-dimethyl-N-[(4-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 2,2-dimethyl-N-[(4-nitrophenyl)carbamothioyl]propanamide Traditional Name: 2,2-dimethyl-N-[(4-nitrophenyl)thiocarbamoyl]propionamide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O3S/c1-12(2,3)10(16)14-11(19)13-8-4-6-9(7-5-8)15(17)18/h4-7H,1-3H3,(H2,13,14,16,19)