N-[(4-nitrophenyl)carbamothioyl]pentanamide

Systemtic Name: N-[(4-nitrophenyl)carbamothioyl]pentanamide Openeye Name: N-[(4-nitrophenyl)carbamothioyl]pentanamide CAS Name: N-[(4-nitroanilino)-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(4-nitrophenyl)carbamothioyl]pentanamide Traditional Name: N-[(4-nitrophenyl)thiocarbamoyl]valeramide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O3S/c1-2-3-4-11(16)14-12(19)13-9-5-7-10(8-6-9)15(17)18/h5-8H,2-4H2,1H3,(H2,13,14,16,19)