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

Systemtic Name: 2-methyl-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]propanamide Openeye Name: 2-methyl-N-[(4-methyl-3-nitro-phenyl)carbamothioyl]propanamide CAS Name: 2-methyl-N-[(4-methyl-3-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 2-methyl-N-[(4-methyl-3-nitrophenyl)carbamothioyl]propanamide Traditional Name: 2-methyl-N-[(4-methyl-3-nitro-phenyl)thiocarbamoyl]propionamide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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