2-methyl-N-[(3-nitrophenyl)carbamothioyl]propanamide

Systemtic Name: 2-methyl-N-[(3-nitrophenyl)carbamothioyl]propanamide Openeye Name: 2-methyl-N-[(3-nitrophenyl)carbamothioyl]propanamide CAS Name: 2-methyl-N-[(3-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 2-methyl-N-[(3-nitrophenyl)carbamothioyl]propanamide Traditional Name: 2-methyl-N-[(3-nitrophenyl)thiocarbamoyl]propionamide Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O3S/c1-7(2)10(15)13-11(18)12-8-4-3-5-9(6-8)14(16)17/h3-7H,1-2H3,(H2,12,13,15,18)