N-(4-nitrophenyl)azocane-1-carbothioamide

Systemtic Name: N-(4-nitrophenyl)azocane-1-carbothioamide Openeye Name: N-(4-nitrophenyl)azocane-1-carbothioamide CAS Name: N-(4-nitrophenyl)-1-azocanecarbothioamide IUPAC Name: N-(4-nitrophenyl)azocane-1-carbothioamide Traditional Name: N-(4-nitrophenyl)azocane-1-carbothioamide Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CCC1)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O2S/c18-17(19)13-8-6-12(7-9-13)15-14(20)16-10-4-2-1-3-5-11-16/h6-9H,1-5,10-11H2,(H,15,20)