N-[(2-chloranyl-5-nitro-phenyl)carbamothioyl]propanamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)carbamothioyl]propanamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)carbamothioyl]propanamide CAS Name: N-[(2-chloro-5-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)carbamothioyl]propanamide Traditional Name: N-[(2-chloro-5-nitro-phenyl)thiocarbamoyl]propionamide Formula: C10H10ClN3O3S MolecularWeight: 287.7227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClN3O3S/c1-2-9(15)13-10(18)12-8-5-6(14(16)17)3-4-7(8)11/h3-5H,2H2,1H3,(H2,12,13,15,18)