N-butyl-4-nitro-benzenecarbothioamide

Systemtic Name: N-butyl-4-nitro-benzenecarbothioamide Openeye Name: N-butyl-4-nitro-benzenecarbothioamide CAS Name: N-butyl-4-nitrobenzenecarbothioamide IUPAC Name: N-butyl-4-nitrobenzenecarbothioamide Traditional Name: N-butyl-4-nitro-thiobenzamide Formula: C11H14N2O2S MolecularWeight: 238.30606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O2S/c1-2-3-8-12-11(16)9-4-6-10(7-5-9)13(14)15/h4-7H,2-3,8H2,1H3,(H,12,16)