N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]butanamide

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]butanamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]butanamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]butanamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]butanamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]butyramide Formula: C11H12ClN3O3S MolecularWeight: 301.74928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12ClN3O3S/c1-2-3-10(16)14-11(19)13-7-4-5-8(12)9(6-7)15(17)18/h4-6H,2-3H2,1H3,(H2,13,14,16,19)